3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-(pyrrolidinomethyl)benzyl]propionamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NCC2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NCC2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C23H31N3O3S/c1-18-9-10-19(2)22(15-18)30(28,29)25-12-11-23(27)24-16-20-7-3-4-8-21(20)17-26-13-5-6-14-26/h3-4,7-10,15,25H,5-6,11-14,16-17H2,1-2H3,(H,24,27)