(E)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-3-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-3-(p-tolyl)prop-2-enamide CAS Name: (E)-N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-3-(p-tolyl)acrylamide Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C=CC2=CC=C(C=C2)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)/C=C/C2=CC=C(C=C2)C)N

InChI

InChI=1S/C22H30N4O3/c1-4-6-14-25(18(27)13-12-17-10-8-16(3)9-11-17)19-20(23)26(15-7-5-2)22(29)24-21(19)28/h8-13H,4-7,14-15,23H2,1-3H3,(H,24,28,29)/b13-12+