3-(1,3-benzodioxol-5-yl)-1-oxidanylidene-2-propyl-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-oxidanylidene-2-propyl-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-[2-(2-thienyl)ethyl]-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-oxo-2-propyl-N-(2-thiophen-2-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-keto-2-propyl-N-[2-(2-thienyl)ethyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCC3=CC=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCC3=CC=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H26N2O4S/c1-2-13-28-24(17-9-10-21-22(15-17)32-16-31-21)23(19-7-3-4-8-20(19)26(28)30)25(29)27-12-11-18-6-5-14-33-18/h3-10,14-15,23-24H,2,11-13,16H2,1H3,(H,27,29)