ethyl 6-[[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[(3-amino-3-oxo-propyl)-benzyl-amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(3-amino-3-oxopropyl)-(phenylmethyl)amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(3-amino-3-oxopropyl)-benzylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(3-amino-3-keto-propyl)-benzyl-amino]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CN(CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CN(CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C18H24N4O4/c1-2-26-17(24)14-10-20-18(25)21-15(14)12-22(9-8-16(19)23)11-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H2,19,23)(H2,20,21,25)