2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-phenyl-1-(1-piperidyl)ethanone CAS Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-phenyl-1-piperidin-1-ylethanone Traditional Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-2-phenyl-1-piperidino-ethanone Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SC(C3=CC=CC=C3)C(=O)N4CCCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SC(C3=CC=CC=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C21H23N3O2S/c1-26-16-10-11-17-18(14-16)23-21(22-17)27-19(15-8-4-2-5-9-15)20(25)24-12-6-3-7-13-24/h2,4-5,8-11,14,19H,3,6-7,12-13H2,1H3,(H,22,23)