(2R)-N-(2-cyanoethyl)-N-methyl-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2-cyanoethyl)-N-methyl-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(2-cyanoethyl)-N-methyl-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: (2R)-N-(2-cyanoethyl)-N-methyl-2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: (2R)-N-(2-cyanoethyl)-N-methyl-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(2-cyanoethyl)-N-methyl-2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C17H18N4O2S3 MolecularWeight: 406.54542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CCC#N)SC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)N(C)CCC#N)SC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H18N4O2S3/c1-12(15(23)21(2)10-6-9-18)25-17-20-19-16(26-17)24-11-14(22)13-7-4-3-5-8-13/h3-5,7-8,12H,6,10-11H2,1-2H3/t12-/m1/s1