(3S)-2-(5-methoxy-4-propan-2-yloxy-pyridin-2-yl)carbonyl-N-(4-pentylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-(5-methoxy-4-propan-2-yloxy-pyridin-2-yl)carbonyl-N-(4-pentylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-(4-isopropoxy-5-methoxy-pyridine-2-carbonyl)-N-(4-pentylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[(5-methoxy-4-propan-2-yloxy-2-pyridinyl)-oxomethyl]-N-(4-pentylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-(5-methoxy-4-propan-2-yloxypyridine-2-carbonyl)-N-(4-pentylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-N-(4-amylphenyl)-2-(4-isopropoxy-5-methoxy-picolinoyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C31H37N3O4 MolecularWeight: 515.64318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=NC=C(C(=C4)OC(C)C)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)[C@@H]2CC3=CC=CC=C3CN2C(=O)C4=NC=C(C(=C4)OC(C)C)OC

InChI

InChI=1S/C31H37N3O4/c1-5-6-7-10-22-13-15-25(16-14-22)33-30(35)27-17-23-11-8-9-12-24(23)20-34(27)31(36)26-18-28(38-21(2)3)29(37-4)19-32-26/h8-9,11-16,18-19,21,27H,5-7,10,17,20H2,1-4H3,(H,33,35)/t27-/m0/s1