methyl 2-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxo-ethyl]sulfanyl-3-isobutyl-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]thio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]sulfanyl-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[[2-[[4-(dimethylamino)benzyl]-methyl-amino]-2-keto-ethyl]thio]-3-isobutyl-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)N(C)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)N(C)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C26H32N4O4S/c1-17(2)14-30-24(32)21-12-9-19(25(33)34-6)13-22(21)27-26(30)35-16-23(31)29(5)15-18-7-10-20(11-8-18)28(3)4/h7-13,17H,14-16H2,1-6H3