2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[1-(m-tolyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[[1-(3-methylphenyl)-2-imidazolyl]thio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[1-(m-tolyl)imidazol-2-yl]thio]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H24N4O3S2/c1-17-6-4-8-19(14-17)26-13-10-23-22(26)30-16-21(27)24-18-7-5-9-20(15-18)31(28,29)25-11-2-3-12-25/h4-10,13-15H,2-3,11-12,16H2,1H3,(H,24,27)