N'-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)-N-[(3-methoxyphenyl)carbonylamino]methanimidamide

Systemtic Name: N'-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)-N-[(3-methoxyphenyl)carbonylamino]methanimidamide Openeye Name: N'-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)-N-[(3-methoxybenzoyl)amino]formamidine CAS Name: N'-[4-cyano-5-(methylthio)-2-phenyl-3-pyrazolyl]-N-[[(3-methoxyphenyl)-oxomethyl]amino]methanimidamide IUPAC Name: N'-(4-cyano-5-methylsulfanyl-2-phenylpyrazol-3-yl)-N-[(3-methoxybenzoyl)amino]methanimidamide Traditional Name: N'-[4-cyano-5-(methylthio)-2-phenyl-pyrazol-3-yl]-N-(m-anisoylamino)formamidine Formula: C20H18N6O2S MolecularWeight: 406.46092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NNC=NC2=C(C(=NN2C3=CC=CC=C3)SC)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NN/C=N/C2=C(C(=NN2C3=CC=CC=C3)SC)C#N

InChI

InChI=1S/C20H18N6O2S/c1-28-16-10-6-7-14(11-16)19(27)24-23-13-22-18-17(12-21)20(29-2)25-26(18)15-8-4-3-5-9-15/h3-11,13H,1-2H3,(H,22,23)(H,24,27)