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

Systemtic Name: 5-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-benzyl-5-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[[1-(3-methoxyphenyl)-2-imidazolyl]thio]methyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-benzyl-5-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-benzyl-5-[[[1-(3-methoxyphenyl)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:

COC1=CC=CC(=C1)N2C=CN=C2SCC3=NN=C(S3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC3=NN=C(S3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H19N5O2S2/c1-28-17-9-5-8-16(12-17)26-11-10-22-21(26)29-14-18-24-25-20(30-18)19(27)23-13-15-6-3-2-4-7-15/h2-12H,13-14H2,1H3,(H,23,27)