O-[3-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate

Systemtic Name: O-[3-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate Openeye Name: O-[3-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate CAS Name: N-phenylcarbamothioic acid O-[3-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]phenyl] ester IUPAC Name: O-[3-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-phenylcarbamothioate Traditional Name: N-phenylthiocarbamic acid O-[3-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]phenyl] ester Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(CCC2)C(=N1)NC3=CC(=CC=C3)OC(=S)NC4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(CCC2)C(=N1)NC3=CC(=CC=C3)OC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS2/c1-28-20-24-18-12-6-11-17(18)19(25-20)22-15-9-5-10-16(13-15)26-21(27)23-14-7-3-2-4-8-14/h2-5,7-10,13H,6,11-12H2,1H3,(H,23,27)(H,22,24,25)