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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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