6-carbamimidoyl-N-[1-(2-methylpropyl)-3,4-dihydroisoquinolin-7-yl]naphthalene-2-carboxamide

Systemtic Name: 6-carbamimidoyl-N-[1-(2-methylpropyl)-3,4-dihydroisoquinolin-7-yl]naphthalene-2-carboxamide Openeye Name: 6-carbamimidoyl-N-(1-isobutyl-3,4-dihydroisoquinolin-7-yl)naphthalene-2-carboxamide CAS Name: 6-carbamimidoyl-N-[1-(2-methylpropyl)-3,4-dihydroisoquinolin-7-yl]-2-naphthalenecarboxamide IUPAC Name: 6-carbamimidoyl-N-[1-(2-methylpropyl)-3,4-dihydroisoquinolin-7-yl]naphthalene-2-carboxamide Traditional Name: 6-amidino-N-(1-isobutyl-3,4-dihydroisoquinolin-7-yl)-2-naphthamide Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NCCC2=C1C=C(C=C2)NC(=O)C3=CC4=C(C=C3)C=C(C=C4)C(=N)N

Isomeric SMILES

CC(C)CC1=NCCC2=C1C=C(C=C2)NC(=O)C3=CC4=C(C=C3)C=C(C=C4)C(=N)N

InChI

InChI=1S/C25H26N4O/c1-15(2)11-23-22-14-21(8-7-16(22)9-10-28-23)29-25(30)20-6-4-17-12-19(24(26)27)5-3-18(17)13-20/h3-8,12-15H,9-11H2,1-2H3,(H3,26,27)(H,29,30)