methyl 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-morpholin-4-ylethyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-morpholin-4-ylethyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-3-(2-morpholinoethyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]-3-[2-(4-morpholinyl)ethyl]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-3-(2-morpholin-4-ylethyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-(p-toluidino)ethyl]thio]-3-(2-morpholinoethyl)quinazoline-7-carboxylic acid methyl ester Formula: C25H28N4O5S MolecularWeight: 496.57862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCN4CCOCC4

InChI

InChI=1S/C25H28N4O5S/c1-17-3-6-19(7-4-17)26-22(30)16-35-25-27-21-15-18(24(32)33-2)5-8-20(21)23(31)29(25)10-9-28-11-13-34-14-12-28/h3-8,15H,9-14,16H2,1-2H3,(H,26,30)