methyl 2-[2-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[[2-keto-2-[methyl-(4-methylcyclohexyl)amino]ethyl]thio]quinazolin-3-yl]acetic acid methyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N(C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

Isomeric SMILES

CC1CCC(CC1)N(C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

InChI

InChI=1S/C21H27N3O4S/c1-14-8-10-15(11-9-14)23(2)18(25)13-29-21-22-17-7-5-4-6-16(17)20(27)24(21)12-19(26)28-3/h4-7,14-15H,8-13H2,1-3H3