propan-2-yl (3R)-3-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl)carbonylamino]-3-(4-methoxyphenyl)propanoate

Systemtic Name: propan-2-yl (3R)-3-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl)carbonylamino]-3-(4-methoxyphenyl)propanoate Openeye Name: isopropyl (3R)-3-[(3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carbonyl)amino]-3-(4-methoxyphenyl)propanoate CAS Name: (3R)-3-[[(3-ethyl-4-oxo-2-sulfanylidene-1H-quinazolin-7-yl)-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3R)-3-[(3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carbonyl)amino]-3-(4-methoxyphenyl)propanoate Traditional Name: (3R)-3-[(3-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carbonyl)amino]-3-(4-methoxyphenyl)propionic acid isopropyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC(CC(=O)OC(C)C)C3=CC=C(C=C3)OC)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N[C@H](CC(=O)OC(C)C)C3=CC=C(C=C3)OC)NC1=S

InChI

InChI=1S/C24H27N3O5S/c1-5-27-23(30)18-11-8-16(12-20(18)26-24(27)33)22(29)25-19(13-21(28)32-14(2)3)15-6-9-17(31-4)10-7-15/h6-12,14,19H,5,13H2,1-4H3,(H,25,29)(H,26,33)/t19-/m1/s1