[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N)C

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N)C

InChI

InChI=1S/C19H17N5O4S/c1-10-12-7-14(29-18(12)23(2)22-10)19(27)28-9-16-21-13-6-4-3-5-11(13)17(26)24(16)8-15(20)25/h3-7H,8-9H2,1-2H3,(H2,20,25)