1-(2-ethylpiperidin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(2-ethylpiperidin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propan-1-one Openeye Name: 1-(2-ethyl-1-piperidyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-propan-1-one CAS Name: 1-(2-ethyl-1-piperidinyl)-2-[(1-methyl-2-benzimidazolyl)thio]-1-propanone IUPAC Name: 1-(2-ethylpiperidin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylpropan-1-one Traditional Name: 1-(2-ethylpiperidino)-2-[(1-methylbenzimidazol-2-yl)thio]propan-1-one Formula: C18H25N3OS MolecularWeight: 331.4756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)SC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CCC1CCCCN1C(=O)C(C)SC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C18H25N3OS/c1-4-14-9-7-8-12-21(14)17(22)13(2)23-18-19-15-10-5-6-11-16(15)20(18)3/h5-6,10-11,13-14H,4,7-9,12H2,1-3H3