2-chloranyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(cyclopropylamino)-2-oxo-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[2-(cyclopropylamino)-2-oxoethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-(cyclopropylamino)-2-oxoethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(cyclopropylamino)-2-keto-ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C16H20ClN3O4S MolecularWeight: 385.8657

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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)NC3CC3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC(=O)NC3CC3

InChI

InChI=1S/C16H20ClN3O4S/c17-14-6-5-12(25(23,24)20-7-1-2-8-20)9-13(14)16(22)18-10-15(21)19-11-3-4-11/h5-6,9,11H,1-4,7-8,10H2,(H,18,22)(H,19,21)