N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2-methylpropylcarbamoyl)phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2-methylpropylcarbamoyl)phenyl]thiophene-2-carboxamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(isobutylcarbamoyl)phenyl]thiophene-2-carboxamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(2-methylpropylamino)-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2-methylpropylcarbamoyl)phenyl]thiophene-2-carboxamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(isobutylcarbamoyl)phenyl]thiophene-2-carboxamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CS2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CS2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H27N3O2S/c1-17(2)15-26-24(29)21-14-20(27-25(30)23-8-5-13-31-23)9-10-22(21)28-12-11-18-6-3-4-7-19(18)16-28/h3-10,13-14,17H,11-12,15-16H2,1-2H3,(H,26,29)(H,27,30)