N-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(3-cyanophenyl)-2,4-bis(oxidanylidene)pyrimidine-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(3-cyanophenyl)-2,4-bis(oxidanylidene)pyrimidine-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(3-cyanophenyl)-2,4-dioxo-pyrimidine-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(3-cyanophenyl)-2,4-dioxo-5-pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(3-cyanophenyl)-2,4-dioxopyrimidine-5-carboxamide Traditional Name: 1-butyl-3-(3-cyanophenyl)-2,4-diketo-N-piperonyl-pyrimidine-5-carboxamide Formula: C24H22N4O5 MolecularWeight: 446.45528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)N(C1=O)C2=CC=CC(=C2)C#N)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCN1C=C(C(=O)N(C1=O)C2=CC=CC(=C2)C#N)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H22N4O5/c1-2-3-9-27-14-19(22(29)26-13-17-7-8-20-21(11-17)33-15-32-20)23(30)28(24(27)31)18-6-4-5-16(10-18)12-25/h4-8,10-11,14H,2-3,9,13,15H2,1H3,(H,26,29)