N-(4-methoxyphenyl)-5-[[1-(3-methylphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-5-[[1-(3-methylphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-methoxyphenyl)-5-[[1-(m-tolyl)imidazol-2-yl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-methoxyphenyl)-5-[[[1-(3-methylphenyl)-2-imidazolyl]thio]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-methoxyphenyl)-5-[[1-(3-methylphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-methoxyphenyl)-5-[[[1-(m-tolyl)imidazol-2-yl]thio]methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C21H19N5O2S2 MolecularWeight: 437.53786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2SCC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2SCC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H19N5O2S2/c1-14-4-3-5-16(12-14)26-11-10-22-21(26)29-13-18-24-25-20(30-18)19(27)23-15-6-8-17(28-2)9-7-15/h3-12H,13H2,1-2H3,(H,23,27)