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

Systemtic Name: O-[3-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-prop-2-enylcarbamothioate Openeye Name: O-[3-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-allylcarbamothioate CAS Name: N-prop-2-enylcarbamothioic 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-prop-2-enylcarbamothioate Traditional Name: N-allylthiocarbamic acid O-[3-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]phenyl] ester Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4OS2/c1-3-10-19-18(24)23-13-7-4-6-12(11-13)20-16-14-8-5-9-15(14)21-17(22-16)25-2/h3-4,6-7,11H,1,5,8-10H2,2H3,(H,19,24)(H,20,21,22)