N-[3-(4-chlorophenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methyl-benzamide

Systemtic Name: N-[3-(4-chlorophenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methyl-benzamide Openeye Name: N-[3-(4-chlorobenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-methyl-benzamide CAS Name: N-[3-[(4-chlorophenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methylbenzamide IUPAC Name: N-[3-(4-chlorobenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methylbenzamide Traditional Name: N-[3-(4-chlorobenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-methyl-benzamide Formula: C23H20ClNO2S MolecularWeight: 409.9284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H20ClNO2S/c1-14-5-4-6-16(13-14)22(27)25-23-20(18-7-2-3-8-19(18)28-23)21(26)15-9-11-17(24)12-10-15/h4-6,9-13H,2-3,7-8H2,1H3,(H,25,27)