methyl 3-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-3-[2-oxo-2-(sec-butylamino)ethyl]quinazoline-7-carboxylate CAS Name: 3-[2-(butan-2-ylamino)-2-oxoethyl]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(butan-2-ylamino)-2-oxoethyl]-4-oxoquinazoline-7-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(sec-butylamino)ethyl]quinazoline-7-carboxylic acid methyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)C(=O)OC

Isomeric SMILES

CCC(C)NC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H19N3O4/c1-4-10(2)18-14(20)8-19-9-17-13-7-11(16(22)23-3)5-6-12(13)15(19)21/h5-7,9-10H,4,8H2,1-3H3,(H,18,20)