3-chloranyl-N-(4-ethylsulfanyl-2-oxidanylidene-butyl)-6H-benzo[b][1,4]benzoxazepine-5-carboxamide

Systemtic Name: 3-chloranyl-N-(4-ethylsulfanyl-2-oxidanylidene-butyl)-6H-benzo[b][1,4]benzoxazepine-5-carboxamide Openeye Name: 3-chloro-N-(4-ethylsulfanyl-2-oxo-butyl)-6H-benzo[b][1,4]benzoxazepine-5-carboxamide CAS Name: 3-chloro-N-[4-(ethylthio)-2-oxobutyl]-6H-benzo[b][1,4]benzoxazepine-5-carboxamide IUPAC Name: 3-chloro-N-(4-ethylsulfanyl-2-oxobutyl)-6H-benzo[b][1,4]benzoxazepine-5-carboxamide Traditional Name: 3-chloro-N-[4-(ethylthio)-2-keto-butyl]-6H-benzo[b][1,4]benzoxazepine-5-carboxamide Formula: C20H21ClN2O3S MolecularWeight: 404.91034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSCCC(=O)CNC(=O)N1CC2=CC=CC=C2OC3=C1C=C(C=C3)Cl

Isomeric SMILES

CCSCCC(=O)CNC(=O)N1CC2=CC=CC=C2OC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O3S/c1-2-27-10-9-16(24)12-22-20(25)23-13-14-5-3-4-6-18(14)26-19-8-7-15(21)11-17(19)23/h3-8,11H,2,9-10,12-13H2,1H3,(H,22,25)