2-chloranyl-N-[3-(3-methylphenyl)propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-(3-methylphenyl)propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[3-(m-tolyl)propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[3-(3-methylphenyl)propyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[3-(3-methylphenyl)propyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[3-(m-tolyl)propyl]-5-pyrrolidinosulfonyl-benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C21H25ClN2O3S/c1-16-6-4-7-17(14-16)8-5-11-23-21(25)19-15-18(9-10-20(19)22)28(26,27)24-12-2-3-13-24/h4,6-7,9-10,14-15H,2-3,5,8,11-13H2,1H3,(H,23,25)