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

Systemtic Name: 5-chloranyl-3-methyl-1-(phenylmethyl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-(phenylmethyl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-(5-p-cumenyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Formula: C23H22ClN5OS MolecularWeight: 451.97168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)C(C)C)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)C(C)C)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C23H22ClN5OS/c1-14(2)17-9-11-18(12-10-17)22-26-27-23(31-22)25-21(30)19-15(3)28-29(20(19)24)13-16-7-5-4-6-8-16/h4-12,14H,13H2,1-3H3,(H,25,27,30)