methyl 2-[1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-(4-chloroanilino)-1-methyl-2-oxo-ethyl]sulfanyl-3-(2-furylmethyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[1-(4-chloroanilino)-1-oxopropan-2-yl]thio]-3-(2-furanylmethyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[1-(4-chloroanilino)-1-oxopropan-2-yl]sulfanyl-3-(furan-2-ylmethyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[[2-(4-chloroanilino)-2-keto-1-methyl-ethyl]thio]-3-(2-furfuryl)-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C24H20ClN3O5S MolecularWeight: 497.9507

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Cl)SC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4=CC=CO4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Cl)SC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C24H20ClN3O5S/c1-14(21(29)26-17-8-6-16(25)7-9-17)34-24-27-20-12-15(23(31)32-2)5-10-19(20)22(30)28(24)13-18-4-3-11-33-18/h3-12,14H,13H2,1-2H3,(H,26,29)