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

Systemtic Name: O-[4-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-ethylcarbamothioate Openeye Name: O-[4-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-ethylcarbamothioate CAS Name: N-ethylcarbamothioic acid O-[4-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]phenyl] ester IUPAC Name: O-[4-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]phenyl] N-ethylcarbamothioate Traditional Name: N-ethylthiocarbamic acid O-[4-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]phenyl] ester Formula: C17H20N4OS2 MolecularWeight: 360.4969

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)OC1=CC=C(C=C1)NC2=NC(=NC3=C2CCC3)SC

Isomeric SMILES

CCNC(=S)OC1=CC=C(C=C1)NC2=NC(=NC3=C2CCC3)SC

InChI

InChI=1S/C17H20N4OS2/c1-3-18-17(23)22-12-9-7-11(8-10-12)19-15-13-5-4-6-14(13)20-16(21-15)24-2/h7-10H,3-6H2,1-2H3,(H,18,23)(H,19,20,21)