1-(4-chloranyl-3-methyl-phenyl)carbonyl-6,6-dimethyl-3-phenylazanyl-5,7-dihydro-2-benzothiophen-4-one

Systemtic Name: 1-(4-chloranyl-3-methyl-phenyl)carbonyl-6,6-dimethyl-3-phenylazanyl-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 3-anilino-1-(4-chloro-3-methyl-benzoyl)-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one CAS Name: 3-anilino-1-[(4-chloro-3-methylphenyl)-oxomethyl]-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 3-anilino-1-(4-chloro-3-methylbenzoyl)-6,6-dimethyl-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 3-anilino-1-(4-chloro-3-methyl-benzoyl)-6,6-dimethyl-5,7-dihydroisobenzothiophen-4-one Formula: C24H22ClNO2S MolecularWeight: 423.95498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2=C3CC(CC(=O)C3=C(S2)NC4=CC=CC=C4)(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C2=C3CC(CC(=O)C3=C(S2)NC4=CC=CC=C4)(C)C)Cl

InChI

InChI=1S/C24H22ClNO2S/c1-14-11-15(9-10-18(14)25)21(28)22-17-12-24(2,3)13-19(27)20(17)23(29-22)26-16-7-5-4-6-8-16/h4-11,26H,12-13H2,1-3H3