4-chloranyl-N-prop-2-enyl-pyrazole-1-carbothioamide

Systemtic Name: 4-chloranyl-N-prop-2-enyl-pyrazole-1-carbothioamide Openeye Name: N-allyl-4-chloro-pyrazole-1-carbothioamide CAS Name: 4-chloro-N-prop-2-enyl-1-pyrazolecarbothioamide IUPAC Name: 4-chloro-N-prop-2-enylpyrazole-1-carbothioamide Traditional Name: N-allyl-4-chloro-pyrazole-1-carbothioamide Formula: C7H8ClN3S MolecularWeight: 201.67652

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N1C=C(C=N1)Cl

Isomeric SMILES

C=CCNC(=S)N1C=C(C=N1)Cl

InChI

InChI=1S/C7H8ClN3S/c1-2-3-9-7(12)11-5-6(8)4-10-11/h2,4-5H,1,3H2,(H,9,12)