methyl 3-[4-oxidanylidene-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[[(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]sulfanylquinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[[(1R)-2-keto-1-methyl-2-piperidino-ethyl]thio]quinazolin-3-yl]propionic acid methyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC

Isomeric SMILES

C[C@H](C(=O)N1CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC

InChI

InChI=1S/C20H25N3O4S/c1-14(18(25)22-11-6-3-7-12-22)28-20-21-16-9-5-4-8-15(16)19(26)23(20)13-10-17(24)27-2/h4-5,8-9,14H,3,6-7,10-13H2,1-2H3/t14-/m1/s1