N-(2-tert-butyl-5-methyl-pyrazol-3-yl)-4-chloranyl-benzenecarbothioamide

Systemtic Name: N-(2-tert-butyl-5-methyl-pyrazol-3-yl)-4-chloranyl-benzenecarbothioamide Openeye Name: N-(2-tert-butyl-5-methyl-pyrazol-3-yl)-4-chloro-benzenecarbothioamide CAS Name: N-(2-tert-butyl-5-methyl-3-pyrazolyl)-4-chlorobenzenecarbothioamide IUPAC Name: N-(2-tert-butyl-5-methylpyrazol-3-yl)-4-chlorobenzenecarbothioamide Traditional Name: N-(2-tert-butyl-5-methyl-pyrazol-3-yl)-4-chloro-thiobenzamide Formula: C15H18ClN3S MolecularWeight: 307.84152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN3S/c1-10-9-13(19(18-10)15(2,3)4)17-14(20)11-5-7-12(16)8-6-11/h5-9H,1-4H3,(H,17,20)