2-[(5-ethylpyridin-2-yl)-piperidin-4-yl-methyl]sulfinyl-6-methoxy-1H-benzimidazole

Systemtic Name: 2-[(5-ethylpyridin-2-yl)-piperidin-4-yl-methyl]sulfinyl-6-methoxy-1H-benzimidazole Openeye Name: 2-[(5-ethyl-2-pyridyl)-(4-piperidyl)methyl]sulfinyl-6-methoxy-1H-benzimidazole CAS Name: 2-[(5-ethyl-2-pyridinyl)-(4-piperidinyl)methyl]sulfinyl-6-methoxy-1H-benzimidazole IUPAC Name: 2-[(5-ethylpyridin-2-yl)-piperidin-4-ylmethyl]sulfinyl-6-methoxy-1H-benzimidazole Traditional Name: 2-[(5-ethyl-2-pyridyl)-(4-piperidyl)methyl]sulfinyl-6-methoxy-1H-benzimidazole Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2CCNCC2)S(=O)C3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2CCNCC2)S(=O)C3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C21H26N4O2S/c1-3-14-4-6-18(23-13-14)20(15-8-10-22-11-9-15)28(26)21-24-17-7-5-16(27-2)12-19(17)25-21/h4-7,12-13,15,20,22H,3,8-11H2,1-2H3,(H,24,25)