N-[2-(1H-indol-3-ylsulfanyl)ethyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(1H-indol-3-ylthio)ethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(1H-indol-3-ylthio)ethyl]-4-piperidinosulfonyl-benzamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O3S2/c26-22(23-12-15-29-21-16-24-20-7-3-2-6-19(20)21)17-8-10-18(11-9-17)30(27,28)25-13-4-1-5-14-25/h2-3,6-11,16,24H,1,4-5,12-15H2,(H,23,26)