2-[3-(cyclopropylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: 2-[3-(cyclopropylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: 2-[3-(cyclopropylmethyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(cyclopropylmethyl)-4-oxo-2-quinazolinyl]thio]acetate IUPAC Name: 2-[3-(cyclopropylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(cyclopropylmethyl)-4-keto-quinazolin-2-yl]thio]acetate Formula: C14H13N2O3S- MolecularWeight: 289.32962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)[O-]

Isomeric SMILES

C1CC1CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)[O-]

InChI

InChI=1S/C14H14N2O3S/c17-12(18)8-20-14-15-11-4-2-1-3-10(11)13(19)16(14)7-9-5-6-9/h1-4,9H,5-8H2,(H,17,18)/p-1