5-[(4-chlorophenyl)methyl]-7-methyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-[(4-chlorophenyl)methyl]-7-methyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-[(4-chlorophenyl)methyl]-7-methyl-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-[(4-chlorophenyl)methyl]-7-methyl-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-[(4-chlorophenyl)methyl]-7-methyl-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-(4-chlorobenzyl)-7-methyl-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C17H16ClNOS MolecularWeight: 317.83304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCCC(=O)N2CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)SCCC(=O)N2CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16ClNOS/c1-12-2-7-16-15(10-12)19(17(20)8-9-21-16)11-13-3-5-14(18)6-4-13/h2-7,10H,8-9,11H2,1H3