5-(4-chloranyl-2,3-dimethyl-1H-pyrazol-2-ium-5-yl)-N-phenyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(4-chloranyl-2,3-dimethyl-1H-pyrazol-2-ium-5-yl)-N-phenyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-(4-chloro-2,3-dimethyl-1H-pyrazol-2-ium-5-yl)-N-phenyl-1,3,4-thiadiazol-2-amine CAS Name: 5-(4-chloro-2,3-dimethyl-1H-pyrazol-2-ium-5-yl)-N-phenyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(4-chloro-2,3-dimethyl-1H-pyrazol-2-ium-5-yl)-N-phenyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-(4-chloro-2,3-dimethyl-1H-pyrazol-2-ium-5-yl)-1,3,4-thiadiazol-2-yl]-phenyl-amine Formula: C13H13ClN5S+ MolecularWeight: 306.79382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](NC(=C1Cl)C2=NN=C(S2)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=[N+](NC(=C1Cl)C2=NN=C(S2)NC3=CC=CC=C3)C

InChI

InChI=1S/C13H12ClN5S/c1-8-10(14)11(18-19(8)2)12-16-17-13(20-12)15-9-6-4-3-5-7-9/h3-7H,1-2H3,(H,15,17,18)/p+1