6-chloranyl-3-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 6-chloranyl-3-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 6-chloro-3-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 6-chloro-3-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 6-chloro-3-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 6-chloro-3-methoxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C17H16ClNO3S MolecularWeight: 349.83184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1C(SC2=C(C(=CC=C2)Cl)NC1=O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1C(SC2=C(C(=CC=C2)Cl)NC1=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H16ClNO3S/c1-21-11-8-6-10(7-9-11)16-15(22-2)17(20)19-14-12(18)4-3-5-13(14)23-16/h3-9,15-16H,1-2H3,(H,19,20)