ethyl 3-[[2-(3-methyl-2-methylsulfanyl-4-oxidanylidene-quinazolin-7-yl)carbonylpyrazolidin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[2-(3-methyl-2-methylsulfanyl-4-oxidanylidene-quinazolin-7-yl)carbonylpyrazolidin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[2-(3-methyl-2-methylsulfanyl-4-oxo-quinazoline-7-carbonyl)pyrazolidine-1-carbonyl]amino]benzoate CAS Name: 3-[[[2-[[3-methyl-2-(methylthio)-4-oxo-7-quinazolinyl]-oxomethyl]-1-pyrazolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3-methyl-2-methylsulfanyl-4-oxoquinazoline-7-carbonyl)pyrazolidine-1-carbonyl]amino]benzoate Traditional Name: 3-[[2-[4-keto-3-methyl-2-(methylthio)quinazoline-7-carbonyl]pyrazolidine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C24H25N5O5S MolecularWeight: 495.5508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=CC4=C(C=C3)C(=O)N(C(=N4)SC)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=CC4=C(C=C3)C(=O)N(C(=N4)SC)C

InChI

InChI=1S/C24H25N5O5S/c1-4-34-22(32)16-7-5-8-17(13-16)25-23(33)29-12-6-11-28(29)20(30)15-9-10-18-19(14-15)26-24(35-3)27(2)21(18)31/h5,7-10,13-14H,4,6,11-12H2,1-3H3,(H,25,33)