N-(2-azanyl-2-oxidanylidene-ethyl)-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(2-amino-2-oxoethyl)-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-amino-2-keto-ethyl)-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C13H16ClN3O4S MolecularWeight: 345.80184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC(=O)N

InChI

InChI=1S/C13H16ClN3O4S/c14-11-4-3-9(22(20,21)17-5-1-2-6-17)7-10(11)13(19)16-8-12(15)18/h3-4,7H,1-2,5-6,8H2,(H2,15,18)(H,16,19)