1-ethyl-5-piperidin-1-ylsulfonyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole

Systemtic Name: 1-ethyl-5-piperidin-1-ylsulfonyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole Openeye Name: 1-ethyl-5-(1-piperidylsulfonyl)-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole CAS Name: 1-ethyl-5-(1-piperidinylsulfonyl)-2-[(2-pyrimidinylthio)methyl]benzimidazole IUPAC Name: 1-ethyl-5-piperidin-1-ylsulfonyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole Traditional Name: 1-ethyl-5-piperidinosulfonyl-2-[(2-pyrimidylthio)methyl]benzimidazole Formula: C19H23N5O2S2 MolecularWeight: 417.54822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NC=CC=N4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NC=CC=N4

InChI

InChI=1S/C19H23N5O2S2/c1-2-24-17-8-7-15(28(25,26)23-11-4-3-5-12-23)13-16(17)22-18(24)14-27-19-20-9-6-10-21-19/h6-10,13H,2-5,11-12,14H2,1H3