7-chloranyl-5-(3,5-dimethylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one

Systemtic Name: 7-chloranyl-5-(3,5-dimethylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one Openeye Name: 7-chloro-5-(3,5-dimethylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one CAS Name: 7-chloro-5-(3,5-dimethylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one IUPAC Name: 7-chloro-5-(3,5-dimethylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one Traditional Name: 7-chloro-5-(3,5-dimethylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one Formula: C17H16ClNOS MolecularWeight: 317.83304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2C3=C(C=CC(=C3)Cl)NC(=O)CS2)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2C3=C(C=CC(=C3)Cl)NC(=O)CS2)C

InChI

InChI=1S/C17H16ClNOS/c1-10-5-11(2)7-12(6-10)17-14-8-13(18)3-4-15(14)19-16(20)9-21-17/h3-8,17H,9H2,1-2H3,(H,19,20)