pyridin-4-ylmethyl 2,4-bis(oxidanylidene)-3-(thiophen-2-ylmethyl)-1H-quinazoline-6-carboxylate

Systemtic Name: pyridin-4-ylmethyl 2,4-bis(oxidanylidene)-3-(thiophen-2-ylmethyl)-1H-quinazoline-6-carboxylate Openeye Name: 4-pyridylmethyl 2,4-dioxo-3-(2-thienylmethyl)-1H-quinazoline-6-carboxylate CAS Name: 2,4-dioxo-3-(thiophen-2-ylmethyl)-1H-quinazoline-6-carboxylic acid pyridin-4-ylmethyl ester IUPAC Name: pyridin-4-ylmethyl 2,4-dioxo-3-(thiophen-2-ylmethyl)-1H-quinazoline-6-carboxylate Traditional Name: 2,4-diketo-3-(2-thenyl)-1H-quinazoline-6-carboxylic acid 4-pyridylmethyl ester Formula: C20H15N3O4S MolecularWeight: 393.4158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN2C(=O)C3=C(C=CC(=C3)C(=O)OCC4=CC=NC=C4)NC2=O

Isomeric SMILES

C1=CSC(=C1)CN2C(=O)C3=C(C=CC(=C3)C(=O)OCC4=CC=NC=C4)NC2=O

InChI

InChI=1S/C20H15N3O4S/c24-18-16-10-14(19(25)27-12-13-5-7-21-8-6-13)3-4-17(16)22-20(26)23(18)11-15-2-1-9-28-15/h1-10H,11-12H2,(H,22,26)