methyl 4-oxidanylidene-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-3-(oxolan-2-ylmethyl)quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-3-(oxolan-2-ylmethyl)quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-(4-oxo-4-phenyl-butyl)sulfanyl-3-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxylate CAS Name: 4-oxo-3-(2-oxolanylmethyl)-2-[(4-oxo-4-phenylbutyl)thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-3-(oxolan-2-ylmethyl)-2-(4-oxo-4-phenylbutyl)sulfanylquinazoline-7-carboxylate Traditional Name: 4-keto-2-[(4-keto-4-phenyl-butyl)thio]-3-(tetrahydrofurfuryl)quinazoline-7-carboxylic acid methyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCCC(=O)C3=CC=CC=C3)CC4CCCO4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCCC(=O)C3=CC=CC=C3)CC4CCCO4

InChI

InChI=1S/C25H26N2O5S/c1-31-24(30)18-11-12-20-21(15-18)26-25(27(23(20)29)16-19-9-5-13-32-19)33-14-6-10-22(28)17-7-3-2-4-8-17/h2-4,7-8,11-12,15,19H,5-6,9-10,13-14,16H2,1H3