N-cyclopropyl-N-[5-[2-[(4-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: N-cyclopropyl-N-[5-[2-[(4-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-cyclopropyl-N-[5-[2-(4-methylsulfonylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-cyclopropyl-N-[5-[[2-(4-methylsulfonylanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-cyclopropyl-N-[5-[2-(4-methylsulfonylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-cyclopropyl-N-[5-[[2-keto-2-(4-mesylanilino)ethyl]thio]-1,3,4-thiadiazol-2-yl]propionamide Formula: C17H20N4O4S3 MolecularWeight: 440.5601

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H20N4O4S3/c1-3-15(23)21(12-6-7-12)16-19-20-17(27-16)26-10-14(22)18-11-4-8-13(9-5-11)28(2,24)25/h4-5,8-9,12H,3,6-7,10H2,1-2H3,(H,18,22)