(5Z)-5-(azepan-1-ylmethylidene)-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: (5Z)-5-(azepan-1-ylmethylidene)-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5Z)-5-(azepan-1-ylmethylene)-1-(2-furylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5Z)-5-(1-azepanylmethylidene)-1-(2-furanylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: (5Z)-5-(azepan-1-ylmethylidene)-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5Z)-5-(azepan-1-ylmethylene)-1-(2-furfuryl)barbituric acid Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3

Isomeric SMILES

C1CCCN(CC1)/C=C\2/C(=O)NC(=O)N(C2=O)CC3=CC=CO3

InChI

InChI=1S/C16H19N3O4/c20-14-13(11-18-7-3-1-2-4-8-18)15(21)19(16(22)17-14)10-12-6-5-9-23-12/h5-6,9,11H,1-4,7-8,10H2,(H,17,20,22)/b13-11-