1-(phenylmethyl)-5-[1-(2-piperazin-1-ylethylamino)ethylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(phenylmethyl)-5-[1-(2-piperazin-1-ylethylamino)ethylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-benzyl-5-[1-(2-piperazin-1-ylethylamino)ethylidene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(phenylmethyl)-5-[1-[2-(1-piperazinyl)ethylamino]ethylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-benzyl-5-[1-(2-piperazin-1-ylethylamino)ethylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-benzyl-5-[1-(2-piperazinoethylamino)ethylidene]barbituric acid Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)NCCN3CCNCC3

Isomeric SMILES

CC(=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)NCCN3CCNCC3

InChI

InChI=1S/C19H25N5O3/c1-14(21-9-12-23-10-7-20-8-11-23)16-17(25)22-19(27)24(18(16)26)13-15-5-3-2-4-6-15/h2-6,20-21H,7-13H2,1H3,(H,22,25,27)