Registration Dossier

General information

Inventory

EC number:
438-020-0
EC name:
-
CAS number:
-
Description:
LACTAM 204,636

No inventory information available

Reference substance information

IUPAC name:
2-thia-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
Synonyms
Names:
10,11-Dihydro-11-oxodibenz[b,f][1,4] thiazepine
10,11-Dihydrodibenzo[b,f][1,4]thiazepin-11-one
Dibenzo[b,f][1,4]thiazepine-11(10-H)-one
Identifier:
CAS number
3159-07-7
Identifier:
IUPAC name
2-thia-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3,5,7,11,13-hexaen-10-one
Identifier:
IUPAC name
Dibenzo-(b,f)(1,4)Thiazepine-11(10H)-one
Identifier:
other: InChl
InChI=1/C13H9NOS/c15-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)14-13/h1-8H,(H,14,15)
Identifier:
other: SMILES notation
O=C2Nc3ccccc3Sc1ccccc12
dibenzo[b,f][1,4]thiazepin-11(10H)-one

CAS information

CAS number:
3159-07-7

Molecular and structural information

Molecular formula:
C13H9NOS
Molecular weight:
ca. 227.283
SMILES notation:
c1cc2c(cc1)Sc3c(C(N2)=O)cccc3
InChl:
1/C13H9NOS/c15-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)14-13/h1-8H,(H,14,15)
Structural formula:
Chemical structure