N-(2-methylphenyl)-2-(2-methylpropyl)-1-oxidanylidene-N-propyl-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(2-methylphenyl)-2-(2-methylpropyl)-1-oxidanylidene-N-propyl-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-isobutyl-N-(o-tolyl)-1-oxo-N-propyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(2-methylphenyl)-2-(2-methylpropyl)-1-oxo-N-propyl-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(2-methylphenyl)-2-(2-methylpropyl)-1-oxo-N-propyl-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-isobutyl-1-keto-N-(o-tolyl)-N-propyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C28H32N2O2S MolecularWeight: 460.63088

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC=C1C)C(=O)C2C(N(C(=O)C3=CC=CC=C23)CC(C)C)C4=CC=CS4

Isomeric SMILES

CCCN(C1=CC=CC=C1C)C(=O)C2C(N(C(=O)C3=CC=CC=C23)CC(C)C)C4=CC=CS4

InChI

InChI=1S/C28H32N2O2S/c1-5-16-29(23-14-9-6-11-20(23)4)28(32)25-21-12-7-8-13-22(21)27(31)30(18-19(2)3)26(25)24-15-10-17-33-24/h6-15,17,19,25-26H,5,16,18H2,1-4H3