propyl 4-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]benzoate

Systemtic Name: propyl 4-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]benzoate Openeye Name: propyl 4-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]benzoate CAS Name: 4-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]benzoate Traditional Name: 4-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]benzoic acid propyl ester Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2CCC3)SC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2CCC3)SC

InChI

InChI=1S/C18H21N3O2S/c1-3-11-23-17(22)12-7-9-13(10-8-12)19-16-14-5-4-6-15(14)20-18(21-16)24-2/h7-10H,3-6,11H2,1-2H3,(H,19,20,21)