1-(2-chlorophenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(2-chlorophenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2-chlorophenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2-chlorophenyl)-5-[[(4-methyl-1-piperazinyl)amino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(2-chlorophenyl)-5-[[(4-methylpiperazin-1-yl)amino]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2-chlorophenyl)-5-[[(4-methylpiperazino)amino]methylene]barbituric acid Formula: C16H18ClN5O3 MolecularWeight: 363.79882

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3Cl

Isomeric SMILES

CN1CCN(CC1)NC=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H18ClN5O3/c1-20-6-8-21(9-7-20)18-10-11-14(23)19-16(25)22(15(11)24)13-5-3-2-4-12(13)17/h2-5,10,18H,6-9H2,1H3,(H,19,23,25)