methyl 2-butylsulfanyl-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-butylsulfanyl-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate Openeye Name: methyl 2-butylsulfanyl-4-oxo-3-phenyl-quinazoline-7-carboxylate CAS Name: 2-(butylthio)-4-oxo-3-phenyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-butylsulfanyl-4-oxo-3-phenylquinazoline-7-carboxylate Traditional Name: 2-(butylthio)-4-keto-3-phenyl-quinazoline-7-carboxylic acid methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CCCCSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-3-4-12-26-20-21-17-13-14(19(24)25-2)10-11-16(17)18(23)22(20)15-8-6-5-7-9-15/h5-11,13H,3-4,12H2,1-2H3