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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O4S/c1-17(2)27(15-18-9-5-4-6-10-18)21(28)16-32-24-25-20-12-8-7-11-19(20)23(30)26(24)14-13-22(29)31-3/h4-12,17H,13-16H2,1-3H3