propan-2-yl (3R)-3-(2-chlorophenyl)-3-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-7-yl)carbonylamino]propanoate

Systemtic Name: propan-2-yl (3R)-3-(2-chlorophenyl)-3-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-7-yl)carbonylamino]propanoate Openeye Name: isopropyl (3R)-3-[(3-allyl-4-oxo-2-thioxo-1H-quinazoline-7-carbonyl)amino]-3-(2-chlorophenyl)propanoate CAS Name: (3R)-3-(2-chlorophenyl)-3-[[oxo-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-7-yl)methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3R)-3-(2-chlorophenyl)-3-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carbonyl)amino]propanoate Traditional Name: (3R)-3-[(3-allyl-4-keto-2-thioxo-1H-quinazoline-7-carbonyl)amino]-3-(2-chlorophenyl)propionic acid isopropyl ester Formula: C24H24ClN3O4S MolecularWeight: 485.98306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CC(C)OC(=O)C[C@H](C1=CC=CC=C1Cl)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C24H24ClN3O4S/c1-4-11-28-23(31)17-10-9-15(12-19(17)27-24(28)33)22(30)26-20(13-21(29)32-14(2)3)16-7-5-6-8-18(16)25/h4-10,12,14,20H,1,11,13H2,2-3H3,(H,26,30)(H,27,33)/t20-/m1/s1