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

Systemtic Name: N-(4-methylphenyl)-5-[(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[(2-morpholino-2-oxo-ethyl)sulfanylmethyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-methylphenyl)-5-[[[2-(4-morpholinyl)-2-oxoethyl]thio]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-methylphenyl)-5-[(2-morpholin-4-yl-2-oxoethyl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[(2-keto-2-morpholino-ethyl)thio]methyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide Formula: C17H20N4O3S2 MolecularWeight: 392.4957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)CSCC(=O)N3CCOCC3

InChI

InChI=1S/C17H20N4O3S2/c1-12-2-4-13(5-3-12)18-16(23)17-20-19-14(26-17)10-25-11-15(22)21-6-8-24-9-7-21/h2-5H,6-11H2,1H3,(H,18,23)