N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-2-(p-tolyl)cinchoninamide Formula: C29H33N5O3 MolecularWeight: 499.60402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C)N

InChI

InChI=1S/C29H33N5O3/c1-4-6-16-33(25-26(30)34(17-7-5-2)29(37)32-27(25)35)28(36)22-18-24(20-14-12-19(3)13-15-20)31-23-11-9-8-10-21(22)23/h8-15,18H,4-7,16-17,30H2,1-3H3,(H,32,35,37)