methyl N'-(4-cyanophenyl)-N-morpholin-4-yl-carbamimidothioate

Systemtic Name: methyl N'-(4-cyanophenyl)-N-morpholin-4-yl-carbamimidothioate Openeye Name: 3-(4-cyanophenyl)-2-methyl-1-morpholino-isothiourea CAS Name: N'-(4-cyanophenyl)-N-(4-morpholinyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(4-cyanophenyl)-N-morpholin-4-ylcarbamimidothioate Traditional Name: 3-(4-cyanophenyl)-2-methyl-1-morpholino-isothiourea Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=C(C=C1)C#N)NN2CCOCC2

Isomeric SMILES

CSC(=NC1=CC=C(C=C1)C#N)NN2CCOCC2

InChI

InChI=1S/C13H16N4OS/c1-19-13(16-17-6-8-18-9-7-17)15-12-4-2-11(10-14)3-5-12/h2-5H,6-9H2,1H3,(H,15,16)