N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-chloranyl-N-methyl-2-(2-oxidanylidenepyrrolidin-1-yl)benzamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-chloranyl-N-methyl-2-(2-oxidanylidenepyrrolidin-1-yl)benzamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-chloro-N-methyl-2-(2-oxopyrrolidin-1-yl)benzamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-chloro-N-methyl-2-(2-oxo-1-pyrrolidinyl)benzamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-chloro-N-methyl-2-(2-oxopyrrolidin-1-yl)benzamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-chloro-2-(2-ketopyrrolidino)-N-methyl-benzamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=C(C=C(C=C3)Cl)N4CCCC4=O

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=C(C=C(C=C3)Cl)N4CCCC4=O

InChI

InChI=1S/C21H20ClN3O2S/c1-13(20-23-16-6-3-4-7-18(16)28-20)24(2)21(27)15-10-9-14(22)12-17(15)25-11-5-8-19(25)26/h3-4,6-7,9-10,12-13H,5,8,11H2,1-2H3/t13-/m1/s1