3-(3-methoxyphenyl)-1-(phenylmethyl)-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-1-(phenylmethyl)-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(3-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide CAS Name: 3-(3-methoxyphenyl)-1-(phenylmethyl)-N-(1,3,4-thiadiazol-2-yl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(3-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(3-methoxyphenyl)-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC3=NN=CS3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC3=NN=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C20H17N5O2S/c1-27-16-9-5-8-15(10-16)18-17(19(26)22-20-23-21-13-28-20)12-25(24-18)11-14-6-3-2-4-7-14/h2-10,12-13H,11H2,1H3,(H,22,23,26)