propan-2-yl 3-[2-(2-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)ethanoylamino]benzoate

Systemtic Name: propan-2-yl 3-[2-(2-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)ethanoylamino]benzoate Openeye Name: isopropyl 3-[[2-(2-methylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)acetyl]amino]benzoate CAS Name: 3-[[2-[2-(methylthio)-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-(2-methylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-[4-keto-2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetyl]amino]benzoic acid isopropyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C3=C(CCC3)N=C2SC

Isomeric SMILES

CC(C)OC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=O)C3=C(CCC3)N=C2SC

InChI

InChI=1S/C20H23N3O4S/c1-12(2)27-19(26)13-6-4-7-14(10-13)21-17(24)11-23-18(25)15-8-5-9-16(15)22-20(23)28-3/h4,6-7,10,12H,5,8-9,11H2,1-3H3,(H,21,24)