ethyl 8-chloranyl-5-oxidanylidene-2-[(phenylmethyl)carbamoyl]-3H-pyrazolo[1,5-c]quinazoline-1-carboxylate

Systemtic Name: ethyl 8-chloranyl-5-oxidanylidene-2-[(phenylmethyl)carbamoyl]-3H-pyrazolo[1,5-c]quinazoline-1-carboxylate Openeye Name: ethyl 2-(benzylcarbamoyl)-8-chloro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1-carboxylate CAS Name: 8-chloro-5-oxo-2-[oxo-[(phenylmethyl)amino]methyl]-3H-pyrazolo[1,5-c]quinazoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzylcarbamoyl)-8-chloro-5-oxo-3H-pyrazolo[1,5-c]quinazoline-1-carboxylate Traditional Name: 2-(benzylcarbamoyl)-8-chloro-5-keto-3H-pyrazolo[1,5-c]quinazoline-1-carboxylic acid ethyl ester Formula: C21H17ClN4O4 MolecularWeight: 424.83708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN2C1=C3C=CC(=CC3=NC2=O)Cl)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NN2C1=C3C=CC(=CC3=NC2=O)Cl)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H17ClN4O4/c1-2-30-20(28)16-17(19(27)23-11-12-6-4-3-5-7-12)25-26-18(16)14-9-8-13(22)10-15(14)24-21(26)29/h3-10,25H,2,11H2,1H3,(H,23,27)