1-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-5-piperidin-1-ylsulfonyl-indole-2-carboxamide

Systemtic Name: 1-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-5-piperidin-1-ylsulfonyl-indole-2-carboxamide Openeye Name: 1-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-5-(1-piperidylsulfonyl)indole-2-carboxamide CAS Name: 1-methyl-N-[2-[4-(methylthio)phenyl]ethyl]-5-(1-piperidinylsulfonyl)-2-indolecarboxamide IUPAC Name: 1-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-5-piperidin-1-ylsulfonylindole-2-carboxamide Traditional Name: 1-methyl-N-[2-[4-(methylthio)phenyl]ethyl]-5-piperidinosulfonyl-indole-2-carboxamide Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C=C1C(=O)NCCC4=CC=C(C=C4)SC

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C=C1C(=O)NCCC4=CC=C(C=C4)SC

InChI

InChI=1S/C24H29N3O3S2/c1-26-22-11-10-21(32(29,30)27-14-4-3-5-15-27)16-19(22)17-23(26)24(28)25-13-12-18-6-8-20(31-2)9-7-18/h6-11,16-17H,3-5,12-15H2,1-2H3,(H,25,28)