3-(3,4-dimethoxyphenyl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-(4-methylsulfanylphenyl)methyleneamino]-1H-pyrazole-5-carboxamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-[4-(methylthio)phenyl]methylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(3,4-dimethoxyphenyl)-N-[(E)-[4-(methylthio)benzylidene]amino]-1H-pyrazole-5-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=C(C=C3)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)SC)OC

InChI

InChI=1S/C20H20N4O3S/c1-26-18-9-6-14(10-19(18)27-2)16-11-17(23-22-16)20(25)24-21-12-13-4-7-15(28-3)8-5-13/h4-12H,1-3H3,(H,22,23)(H,24,25)/b21-12+