5-chloranyl-3-methyl-1-phenyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Openeye Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-phenyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C20H16ClN5OS MolecularWeight: 409.89194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)CC3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)CC3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H16ClN5OS/c1-13-17(18(21)26(25-13)15-10-6-3-7-11-15)19(27)22-20-24-23-16(28-20)12-14-8-4-2-5-9-14/h2-11H,12H2,1H3,(H,22,24,27)