ethyl 2-azanyl-4-oxidanylidene-5-(4-phenylbutyl)-1H-pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-azanyl-4-oxidanylidene-5-(4-phenylbutyl)-1H-pyrimidine-6-carboxylate Openeye Name: ethyl 2-amino-4-oxo-5-(4-phenylbutyl)-1H-pyrimidine-6-carboxylate CAS Name: 2-amino-4-oxo-5-(4-phenylbutyl)-1H-pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-oxo-5-(4-phenylbutyl)-1H-pyrimidine-6-carboxylate Traditional Name: 2-amino-4-keto-5-(4-phenylbutyl)-1H-pyrimidine-6-carboxylic acid ethyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N=C(N1)N)CCCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N=C(N1)N)CCCCC2=CC=CC=C2

InChI

InChI=1S/C17H21N3O3/c1-2-23-16(22)14-13(15(21)20-17(18)19-14)11-7-6-10-12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3,(H3,18,19,20,21)