N-(4-bromophenyl)-2-(2-methylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(4-bromophenyl)-2-(2-methylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(4-bromophenyl)-2-(2-methylpropanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(4-bromophenyl)-2-[(2-methyl-1-oxopropyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(4-bromophenyl)-2-(2-methylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(4-bromophenyl)-2-(isobutyrylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O2S/c1-11(2)17(23)22-19-16(14-5-3-4-6-15(14)25-19)18(24)21-13-9-7-12(20)8-10-13/h7-11H,3-6H2,1-2H3,(H,21,24)(H,22,23)