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

Systemtic Name: 1-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-methylthiourea Traditional Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-methyl-thiourea Formula: C13H14ClN5S MolecularWeight: 307.80176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=S)NC)Cl)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClN5S/c1-9-11(8-16-17-13(20)15-2)12(14)19(18-9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H2,15,17,20)/b16-8+