methyl 4-oxidanylidene-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-3-pentyl-2-thioxo-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxylate Traditional Name: 3-amyl-4-keto-2-thioxo-1H-quinazoline-7-carboxylic acid methyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)NC1=S

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)NC1=S

InChI

InChI=1S/C15H18N2O3S/c1-3-4-5-8-17-13(18)11-7-6-10(14(19)20-2)9-12(11)16-15(17)21/h6-7,9H,3-5,8H2,1-2H3,(H,16,21)