N-(3-bromophenyl)-2-[(3-chlorophenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(3-bromophenyl)-2-[(3-chlorophenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(3-bromophenyl)-2-[(3-chlorobenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(3-bromophenyl)-2-[[(3-chlorophenyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(3-bromophenyl)-2-[(3-chlorobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(3-bromophenyl)-2-[(3-chlorobenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H18BrClN2O2S MolecularWeight: 489.81252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)Cl)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)Cl)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H18BrClN2O2S/c23-14-6-4-8-16(12-14)25-21(28)19-17-9-1-2-10-18(17)29-22(19)26-20(27)13-5-3-7-15(24)11-13/h3-8,11-12H,1-2,9-10H2,(H,25,28)(H,26,27)