N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanamide

Systemtic Name: N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanamide Openeye Name: N-[2-chloro-5-(1-piperidylsulfonyl)phenyl]-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide CAS Name: N-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-2-[methyl-[[4-(methylthio)phenyl]methyl]amino]acetamide IUPAC Name: N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide Traditional Name: N-(2-chloro-5-piperidinosulfonyl-phenyl)-2-[methyl-[4-(methylthio)benzyl]amino]acetamide Formula: C22H28ClN3O3S2 MolecularWeight: 482.05902

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C22H28ClN3O3S2/c1-25(15-17-6-8-18(30-2)9-7-17)16-22(27)24-21-14-19(10-11-20(21)23)31(28,29)26-12-4-3-5-13-26/h6-11,14H,3-5,12-13,15-16H2,1-2H3,(H,24,27)