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

Systemtic Name: 2-[(2-bromophenyl)carbonylamino]-N-naphthalen-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2-bromobenzoyl)amino]-N-(1-naphthyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(2-bromophenyl)-oxomethyl]amino]-N-(1-naphthalenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(2-bromobenzoyl)amino]-N-naphthalen-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(2-bromobenzoyl)amino]-N-(1-naphthyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C26H21BrN2O2S MolecularWeight: 505.42614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3Br)C(=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3Br)C(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H21BrN2O2S/c27-20-13-5-3-11-18(20)24(30)29-26-23(19-12-4-6-15-22(19)32-26)25(31)28-21-14-7-9-16-8-1-2-10-17(16)21/h1-3,5,7-11,13-14H,4,6,12,15H2,(H,28,31)(H,29,30)