2-[3-(cyclobutylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-(cyclobutylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoic acid Openeye Name: 2-[3-(cyclobutylmethyl)-4-oxo-quinazolin-2-yl]sulfanylacetic acid CAS Name: 2-[[3-(cyclobutylmethyl)-4-oxo-2-quinazolinyl]thio]acetic acid IUPAC Name: 2-[3-(cyclobutylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetic acid Traditional Name: 2-[[3-(cyclobutylmethyl)-4-keto-quinazolin-2-yl]thio]acetic acid Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)O

Isomeric SMILES

C1CC(C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)O

InChI

InChI=1S/C15H16N2O3S/c18-13(19)9-21-15-16-12-7-2-1-6-11(12)14(20)17(15)8-10-4-3-5-10/h1-2,6-7,10H,3-5,8-9H2,(H,18,19)