(2S)-N-(2-methylpropyl)-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide

Systemtic Name: (2S)-N-(2-methylpropyl)-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: (2S)-N-isobutyl-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: (2S)-N-(2-methylpropyl)-2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: (2S)-N-(2-methylpropyl)-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: (2S)-N-isobutyl-2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C17H21N3O2S3 MolecularWeight: 395.56254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)SC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)SC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H21N3O2S3/c1-11(2)9-18-15(22)12(3)24-17-20-19-16(25-17)23-10-14(21)13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,18,22)/t12-/m0/s1