1-[(E)-(3-chloranyl-5-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(3-chloranyl-5-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]thiourea Openeye Name: [(E)-(3-chloro-5-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]thiourea CAS Name: [(E)-(3-chloro-5-methyl-1-phenyl-4-pyrazolyl)methylideneamino]thiourea IUPAC Name: [(E)-(3-chloro-5-methyl-1-phenylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: [(E)-(3-chloro-5-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]thiourea Formula: C12H12ClN5S MolecularWeight: 293.77518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)Cl)C=NNC(=S)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)Cl)/C=N/NC(=S)N

InChI

InChI=1S/C12H12ClN5S/c1-8-10(7-15-16-12(14)19)11(13)17-18(8)9-5-3-2-4-6-9/h2-7H,1H3,(H3,14,16,19)/b15-7+