[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-(2-ethylsulfanylphenyl)methanone

Systemtic Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-(2-ethylsulfanylphenyl)methanone Openeye Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]-1-piperidyl]-(2-ethylsulfanylphenyl)methanone CAS Name: [4-[(5,6-dimethyl-1-benzimidazolyl)methyl]-1-piperidinyl]-[2-(ethylthio)phenyl]methanone IUPAC Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-(2-ethylsulfanylphenyl)methanone Traditional Name: [4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidino]-[2-(ethylthio)phenyl]methanone Formula: C24H29N3OS MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)N2CCC(CC2)CN3C=NC4=C3C=C(C(=C4)C)C

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)N2CCC(CC2)CN3C=NC4=C3C=C(C(=C4)C)C

InChI

InChI=1S/C24H29N3OS/c1-4-29-23-8-6-5-7-20(23)24(28)26-11-9-19(10-12-26)15-27-16-25-21-13-17(2)18(3)14-22(21)27/h5-8,13-14,16,19H,4,9-12,15H2,1-3H3