2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-[(2S)-2-ethylpiperidin-1-yl]ethanone

Systemtic Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-[(2S)-2-ethylpiperidin-1-yl]ethanone Openeye Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-[(2S)-2-ethyl-1-piperidyl]ethanone CAS Name: 2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-1-[(2S)-2-ethyl-1-piperidinyl]ethanone IUPAC Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-[(2S)-2-ethylpiperidin-1-yl]ethanone Traditional Name: 1-[(2S)-2-ethylpiperidino]-2-[(1-p-phenetylbenzimidazol-2-yl)thio]ethanone Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OCC

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OCC

InChI

InChI=1S/C24H29N3O2S/c1-3-18-9-7-8-16-26(18)23(28)17-30-24-25-21-10-5-6-11-22(21)27(24)19-12-14-20(15-13-19)29-4-2/h5-6,10-15,18H,3-4,7-9,16-17H2,1-2H3/t18-/m0/s1