5-ethyl-5-pentan-2-yl-1-[4-(4-phenylpiperazin-1-yl)butyl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-ethyl-5-pentan-2-yl-1-[4-(4-phenylpiperazin-1-yl)butyl]-1,3-diazinane-2,4,6-trione Openeye Name: 5-ethyl-5-(1-methylbutyl)-1-[4-(4-phenylpiperazin-1-yl)butyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-ethyl-5-pentan-2-yl-1-[4-(4-phenyl-1-piperazinyl)butyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-ethyl-5-pentan-2-yl-1-[4-(4-phenylpiperazin-1-yl)butyl]-1,3-diazinane-2,4,6-trione Traditional Name: 5-ethyl-5-(1-methylbutyl)-1-[4-(4-phenylpiperazino)butyl]barbituric acid Formula: C25H38N4O3 MolecularWeight: 442.59422

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(C(=O)NC(=O)N(C1=O)CCCCN2CCN(CC2)C3=CC=CC=C3)CC

Isomeric SMILES

CCCC(C)C1(C(=O)NC(=O)N(C1=O)CCCCN2CCN(CC2)C3=CC=CC=C3)CC

InChI

InChI=1S/C25H38N4O3/c1-4-11-20(3)25(5-2)22(30)26-24(32)29(23(25)31)15-10-9-14-27-16-18-28(19-17-27)21-12-7-6-8-13-21/h6-8,12-13,20H,4-5,9-11,14-19H2,1-3H3,(H,26,30,32)