(2-ethylsulfanylbenzimidazol-1-yl)-(4-piperidin-1-ylsulfonylphenyl)methanone

Systemtic Name: (2-ethylsulfanylbenzimidazol-1-yl)-(4-piperidin-1-ylsulfonylphenyl)methanone Openeye Name: (2-ethylsulfanylbenzimidazol-1-yl)-[4-(1-piperidylsulfonyl)phenyl]methanone CAS Name: [2-(ethylthio)-1-benzimidazolyl]-[4-(1-piperidinylsulfonyl)phenyl]methanone IUPAC Name: (2-ethylsulfanylbenzimidazol-1-yl)-(4-piperidin-1-ylsulfonylphenyl)methanone Traditional Name: [2-(ethylthio)benzimidazol-1-yl]-(4-piperidinosulfonylphenyl)methanone Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCSC1=NC2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H23N3O3S2/c1-2-28-21-22-18-8-4-5-9-19(18)24(21)20(25)16-10-12-17(13-11-16)29(26,27)23-14-6-3-7-15-23/h4-5,8-13H,2-3,6-7,14-15H2,1H3