1-[(E)-(3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]thiourea Openeye Name: [(E)-(3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]thiourea CAS Name: [(E)-(3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]thiourea IUPAC Name: [(E)-(3-methyl-1-phenylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: [(E)-(3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]thiourea Formula: C12H13N5S MolecularWeight: 259.33012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C=NNC(=S)N)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C=C1/C=N/NC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C12H13N5S/c1-9-10(7-14-15-12(13)18)8-17(16-9)11-5-3-2-4-6-11/h2-8H,1H3,(H3,13,15,18)/b14-7+