2-chloranyl-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C17H24ClN3O4S MolecularWeight: 401.90816

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl

InChI

InChI=1S/C17H24ClN3O4S/c1-3-8-19-16(22)12(2)20-17(23)14-11-13(6-7-15(14)18)26(24,25)21-9-4-5-10-21/h6-7,11-12H,3-5,8-10H2,1-2H3,(H,19,22)(H,20,23)/t12-/m0/s1