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

Systemtic Name: N-[3-(4-bromophenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-benzamide Openeye Name: N-[3-(4-bromobenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-benzamide CAS Name: N-[3-[(4-bromophenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide IUPAC Name: N-[3-(4-bromobenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide Traditional Name: N-[3-(4-bromobenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-benzamide Formula: C23H20BrNO2S MolecularWeight: 454.3794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H20BrNO2S/c1-14-6-2-3-7-17(14)22(27)25-23-20(18-8-4-5-9-19(18)28-23)21(26)15-10-12-16(24)13-11-15/h2-3,6-7,10-13H,4-5,8-9H2,1H3,(H,25,27)