N-butan-2-yl-2-(2-methoxyethyl)-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-2-(2-methoxyethyl)-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-(2-methoxyethyl)-1-oxo-N-sec-butyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-butan-2-yl-2-(2-methoxyethyl)-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-butan-2-yl-2-(2-methoxyethyl)-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 1-keto-2-(2-methoxyethyl)-N-sec-butyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1C(N(C(=O)C2=CC=CC=C12)CCOC)C3=CC=CS3

Isomeric SMILES

CCC(C)NC(=O)C1C(N(C(=O)C2=CC=CC=C12)CCOC)C3=CC=CS3

InChI

InChI=1S/C21H26N2O3S/c1-4-14(2)22-20(24)18-15-8-5-6-9-16(15)21(25)23(11-12-26-3)19(18)17-10-7-13-27-17/h5-10,13-14,18-19H,4,11-12H2,1-3H3,(H,22,24)