(Z)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enethioamide

Systemtic Name: (Z)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enethioamide Openeye Name: (Z)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-prop-2-enethioamide CAS Name: (Z)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-cyano-2-propenethioamide IUPAC Name: (Z)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-2-cyanoprop-2-enethioamide Traditional Name: (Z)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-thioacrylamide Formula: C14H11ClN4S MolecularWeight: 302.78194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C#N)C(=S)N)Cl)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN4S/c1-9-12(7-10(8-16)14(17)20)13(15)19(18-9)11-5-3-2-4-6-11/h2-7H,1H3,(H2,17,20)/b10-7-