N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-[methyl-[(2-nitrophenyl)methyl]amino]propanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-[methyl-[(2-nitrophenyl)methyl]amino]propanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-[methyl-[(2-nitrophenyl)methyl]amino]propanamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-3-[methyl-[(2-nitrophenyl)methyl]amino]propanamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-3-[methyl-[(2-nitrophenyl)methyl]amino]propanamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-3-[methyl-(2-nitrobenzyl)amino]propionamide Formula: C21H25ClN4O5S MolecularWeight: 480.965

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(CCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25ClN4O5S/c1-24(15-16-6-2-3-7-20(16)26(28)29)13-10-21(27)23-19-14-17(8-9-18(19)22)32(30,31)25-11-4-5-12-25/h2-3,6-9,14H,4-5,10-13,15H2,1H3,(H,23,27)