N-butan-2-yl-7-(pyridin-4-ylcarbonylamino)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-butan-2-yl-7-(pyridin-4-ylcarbonylamino)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 7-(pyridine-4-carbonylamino)-N-sec-butyl-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-butan-2-yl-7-[[oxo(pyridin-4-yl)methyl]amino]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-butan-2-yl-7-(pyridine-4-carbonylamino)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 7-isonicotinamido-N-sec-butyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=NC=C3

Isomeric SMILES

CCC(C)NC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C20H24N4O2/c1-3-14(2)22-20(26)24-11-8-15-4-5-18(12-17(15)13-24)23-19(25)16-6-9-21-10-7-16/h4-7,9-10,12,14H,3,8,11,13H2,1-2H3,(H,22,26)(H,23,25)