methyl 2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxo-ethyl]sulfanyl-3-(2-furylmethyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[2-[1-cyclohexenyl(cyclopropyl)amino]-2-oxoethyl]thio]-3-(2-furanylmethyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]sulfanyl-3-(furan-2-ylmethyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-keto-ethyl]thio]-3-(2-furfuryl)-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)N(C3CC3)C4=CCCCC4)CC5=CC=CO5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)N(C3CC3)C4=CCCCC4)CC5=CC=CO5

InChI

InChI=1S/C26H27N3O5S/c1-33-25(32)17-9-12-21-22(14-17)27-26(28(24(21)31)15-20-8-5-13-34-20)35-16-23(30)29(19-10-11-19)18-6-3-2-4-7-18/h5-6,8-9,12-14,19H,2-4,7,10-11,15-16H2,1H3