1,5-dimethyl-N-phenethyl-pyrazole-4-carbothioamide

Systemtic Name: 1,5-dimethyl-N-phenethyl-pyrazole-4-carbothioamide Openeye Name: 1,5-dimethyl-N-phenethyl-pyrazole-4-carbothioamide CAS Name: 1,5-dimethyl-N-phenethyl-4-pyrazolecarbothioamide IUPAC Name: 1,5-dimethyl-N-phenethylpyrazole-4-carbothioamide Traditional Name: 1,5-dimethyl-N-phenethyl-pyrazole-4-carbothioamide Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=NN1C)C(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C14H17N3S/c1-11-13(10-16-17(11)2)14(18)15-9-8-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3,(H,15,18)