3-(furan-2-ylmethyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-N-(oxolan-2-ylmethyl)quinazoline-7-carboxamide

Systemtic Name: 3-(furan-2-ylmethyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-N-(oxolan-2-ylmethyl)quinazoline-7-carboxamide Openeye Name: 3-(2-furylmethyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-N-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxamide CAS Name: 3-(2-furanylmethyl)-2-[[2-(4-methylanilino)-2-oxoethyl]thio]-4-oxo-N-(2-oxolanylmethyl)-7-quinazolinecarboxamide IUPAC Name: 3-(furan-2-ylmethyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-4-oxo-N-(oxolan-2-ylmethyl)quinazoline-7-carboxamide Traditional Name: 3-(2-furfuryl)-4-keto-2-[[2-keto-2-(p-toluidino)ethyl]thio]-N-(tetrahydrofurfuryl)quinazoline-7-carboxamide Formula: C28H28N4O5S MolecularWeight: 532.61072

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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)NCC4CCCO4)C(=O)N2CC5=CC=CO5

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C=CC(=C3)C(=O)NCC4CCCO4)C(=O)N2CC5=CC=CO5

InChI

InChI=1S/C28H28N4O5S/c1-18-6-9-20(10-7-18)30-25(33)17-38-28-31-24-14-19(26(34)29-15-21-4-2-12-36-21)8-11-23(24)27(35)32(28)16-22-5-3-13-37-22/h3,5-11,13-14,21H,2,4,12,15-17H2,1H3,(H,29,34)(H,30,33)