2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2-methylsulfanyl-4-methylsulfinyl-pyridin-3-yl)ethanamide

Systemtic Name: 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2-methylsulfanyl-4-methylsulfinyl-pyridin-3-yl)ethanamide Openeye Name: 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2-methylsulfanyl-4-methylsulfinyl-3-pyridyl)acetamide CAS Name: 2-[4-[2-(1H-benzimidazol-2-ylthio)ethyl]-1-piperazinyl]-N-[6-methyl-4-methylsulfinyl-2-(methylthio)-3-pyridinyl]acetamide IUPAC Name: 2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-(6-methyl-2-methylsulfanyl-4-methylsulfinylpyridin-3-yl)acetamide Traditional Name: 2-[4-[2-(1H-benzimidazol-2-ylthio)ethyl]piperazino]-N-[6-methyl-4-methylsulfinyl-2-(methylthio)-3-pyridyl]acetamide Formula: C23H30N6O2S3 MolecularWeight: 518.7183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)S(=O)C)NC(=O)CN2CCN(CC2)CCSC3=NC4=CC=CC=C4N3)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)S(=O)C)NC(=O)CN2CCN(CC2)CCSC3=NC4=CC=CC=C4N3)SC

InChI

InChI=1S/C23H30N6O2S3/c1-16-14-19(34(3)31)21(22(24-16)32-2)27-20(30)15-29-10-8-28(9-11-29)12-13-33-23-25-17-6-4-5-7-18(17)26-23/h4-7,14H,8-13,15H2,1-3H3,(H,25,26)(H,27,30)