3-cyclopentyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 3-cyclopentyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxylate Openeye Name: 3-cyclopentyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxylate CAS Name: 3-cyclopentyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate IUPAC Name: 3-cyclopentyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate Traditional Name: 3-cyclopentyl-4-keto-2-thioxo-1H-quinazoline-7-carboxylate Formula: C14H13N2O3S- MolecularWeight: 289.32962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=C(C=C(C=C3)C(=O)[O-])NC2=S

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=C(C=C(C=C3)C(=O)[O-])NC2=S

InChI

InChI=1S/C14H14N2O3S/c17-12-10-6-5-8(13(18)19)7-11(10)15-14(20)16(12)9-3-1-2-4-9/h5-7,9H,1-4H2,(H,15,20)(H,18,19)/p-1