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

Systemtic Name: 2-[(2-bromophenyl)carbonylamino]-6-tert-butyl-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2-bromobenzoyl)amino]-6-tert-butyl-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(2-bromophenyl)-oxomethyl]amino]-6-tert-butyl-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(2-bromobenzoyl)amino]-6-tert-butyl-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(2-bromobenzoyl)amino]-6-tert-butyl-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C26H27BrN2O2S MolecularWeight: 511.47378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC=C3)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC=C3)NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C26H27BrN2O2S/c1-26(2,3)16-13-14-19-21(15-16)32-25(29-23(30)18-11-7-8-12-20(18)27)22(19)24(31)28-17-9-5-4-6-10-17/h4-12,16H,13-15H2,1-3H3,(H,28,31)(H,29,30)