S-[[6-chloranyl-5-(2-methoxyphenoxy)-1,2-dihydropyrimidin-2-yl]] carbamothioate

Systemtic Name: S-[[6-chloranyl-5-(2-methoxyphenoxy)-1,2-dihydropyrimidin-2-yl]] carbamothioate Openeye Name: S-[[6-chloro-5-(2-methoxyphenoxy)-1,2-dihydropyrimidin-2-yl]] carbamothioate CAS Name: carbamothioic acid S-[[6-chloro-5-(2-methoxyphenoxy)-1,2-dihydropyrimidin-2-yl]] ester IUPAC Name: S-[[6-chloro-5-(2-methoxyphenoxy)-1,2-dihydropyrimidin-2-yl]] carbamothioate Traditional Name: thiocarbamic acid S-[[6-chloro-5-(2-methoxyphenoxy)-1,2-dihydropyrimidin-2-yl]] ester Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=C(NC(N=C2)SC(=O)N)Cl

Isomeric SMILES

COC1=CC=CC=C1OC2=C(NC(N=C2)SC(=O)N)Cl

InChI

InChI=1S/C12H12ClN3O3S/c1-18-7-4-2-3-5-8(7)19-9-6-15-12(16-10(9)13)20-11(14)17/h2-6,12,16H,1H3,(H2,14,17)