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

Systemtic Name: N-(4-methylphenyl)-5-[[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]sulfanylmethyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-methylphenyl)-5-[[[2-oxo-2-(2-oxolanylmethylamino)ethyl]thio]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-methylphenyl)-5-[[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[[2-keto-2-(tetrahydrofurfurylamino)ethyl]thio]methyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide Formula: C18H22N4O3S2 MolecularWeight: 406.52228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NCC3CCCO3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)NCC3CCCO3

InChI

InChI=1S/C18H22N4O3S2/c1-12-4-6-13(7-5-12)20-17(24)18-22-21-16(27-18)11-26-10-15(23)19-9-14-3-2-8-25-14/h4-7,14H,2-3,8-11H2,1H3,(H,19,23)(H,20,24)