2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2S)-3-methyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2S)-3-methyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(1S)-2-methyl-1-(pyrrolidine-1-carbonyl)propyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(2S)-3-methyl-1-oxo-1-(1-pyrrolidinyl)butan-2-yl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2S)-3-methyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(1S)-2-methyl-1-(pyrrolidine-1-carbonyl)propyl]acetamide Formula: C18H23N3O2S2 MolecularWeight: 377.52412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1)NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCCC1)NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H23N3O2S2/c1-12(2)16(17(23)21-9-5-6-10-21)20-15(22)11-24-18-19-13-7-3-4-8-14(13)25-18/h3-4,7-8,12,16H,5-6,9-11H2,1-2H3,(H,20,22)/t16-/m0/s1