1-[(E)-[(4E)-5-oxidanylidene-1-phenyl-4-(phenylhydrazinylidene)pyrazol-3-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[(4E)-5-oxidanylidene-1-phenyl-4-(phenylhydrazinylidene)pyrazol-3-yl]methylideneamino]thiourea Openeye Name: [(E)-[(4E)-5-oxo-1-phenyl-4-(phenylhydrazono)pyrazol-3-yl]methyleneamino]thiourea CAS Name: [(E)-[(4E)-5-oxo-1-phenyl-4-(phenylhydrazinylidene)-3-pyrazolyl]methylideneamino]thiourea IUPAC Name: [(E)-[(4E)-5-oxo-1-phenyl-4-(phenylhydrazinylidene)pyrazol-3-yl]methylideneamino]thiourea Traditional Name: [(E)-[(4E)-5-keto-1-phenyl-4-(phenylhydrazono)-2-pyrazolin-3-yl]methyleneamino]thiourea Formula: C17H15N7OS MolecularWeight: 365.4123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN=C2C(=NN(C2=O)C3=CC=CC=C3)C=NNC(=S)N

Isomeric SMILES

C1=CC=C(C=C1)N/N=C/2\C(=NN(C2=O)C3=CC=CC=C3)/C=N/NC(=S)N

InChI

InChI=1S/C17H15N7OS/c18-17(26)22-19-11-14-15(21-20-12-7-3-1-4-8-12)16(25)24(23-14)13-9-5-2-6-10-13/h1-11,20H,(H3,18,22,26)/b19-11+,21-15+