4-(methylsulfanylmethyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 4-(methylsulfanylmethyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 4-(methylsulfanylmethyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 4-[(methylthio)methyl]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(methylsulfanylmethyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-[(methylthio)methyl]-N-(3-pyrrolidinosulfonylphenyl)benzamide Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H22N2O3S2/c1-25-14-15-7-9-16(10-8-15)19(22)20-17-5-4-6-18(13-17)26(23,24)21-11-2-3-12-21/h4-10,13H,2-3,11-12,14H2,1H3,(H,20,22)