(2R)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-phenyl-propanamide

Systemtic Name: (2R)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-phenyl-propanamide Openeye Name: (2R)-2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-N-phenyl-propanamide CAS Name: (2R)-2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]-N-phenylpropanamide IUPAC Name: (2R)-2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-phenylpropanamide Traditional Name: (2R)-2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]-N-phenyl-propionamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SC(C)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1S[C@H](C)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O3S2/c1-3-27-21-13-12-19(32(29,30)26-14-8-5-9-15-26)16-20(21)25-23(27)31-17(2)22(28)24-18-10-6-4-7-11-18/h4,6-7,10-13,16-17H,3,5,8-9,14-15H2,1-2H3,(H,24,28)/t17-/m1/s1