5-[[2-(cycloheptylamino)-2-oxidanylidene-ethyl]sulfanylmethyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[[2-(cycloheptylamino)-2-oxidanylidene-ethyl]sulfanylmethyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[[2-(cycloheptylamino)-2-oxo-ethyl]sulfanylmethyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[[2-(cycloheptylamino)-2-oxoethyl]thio]methyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[[2-(cycloheptylamino)-2-oxoethyl]sulfanylmethyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[[2-(cycloheptylamino)-2-keto-ethyl]thio]methyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide Formula: C20H26N4O2S2 MolecularWeight: 418.57604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NC3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NC3CCCCCC3

InChI

InChI=1S/C20H26N4O2S2/c1-14-8-10-16(11-9-14)22-19(26)20-24-23-18(28-20)13-27-12-17(25)21-15-6-4-2-3-5-7-15/h8-11,15H,2-7,12-13H2,1H3,(H,21,25)(H,22,26)