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

Systemtic Name: 2-[(3-bromophenyl)carbonylamino]-6-tert-butyl-N-(2-ethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(3-bromobenzoyl)amino]-6-tert-butyl-N-(2-ethylphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-6-tert-butyl-N-(2-ethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(3-bromobenzoyl)amino]-6-tert-butyl-N-(2-ethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(3-bromobenzoyl)amino]-6-tert-butyl-N-(2-ethylphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C28H31BrN2O2S MolecularWeight: 539.52694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C28H31BrN2O2S/c1-5-17-9-6-7-12-22(17)30-26(33)24-21-14-13-19(28(2,3)4)16-23(21)34-27(24)31-25(32)18-10-8-11-20(29)15-18/h6-12,15,19H,5,13-14,16H2,1-4H3,(H,30,33)(H,31,32)