methyl 3-[2-[2-[(2,4-dimethylphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[2-[2-[(2,4-dimethylphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[2-[(2,4-dimethylphenyl)methyl-methyl-amino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[2-[[2-[(2,4-dimethylphenyl)methyl-methylamino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[2-[(2,4-dimethylphenyl)methyl-methylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propanoate Traditional Name: 3-[2-[[2-[(2,4-dimethylbenzyl)-methyl-amino]-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC)C

InChI

InChI=1S/C24H27N3O4S/c1-16-9-10-18(17(2)13-16)14-26(3)21(28)15-32-24-25-20-8-6-5-7-19(20)23(30)27(24)12-11-22(29)31-4/h5-10,13H,11-12,14-15H2,1-4H3