2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-[(2S)-pentan-2-yl]ethanamide

Systemtic Name: 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-[(2S)-pentan-2-yl]ethanamide Openeye Name: 2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-N-[(1S)-1-methylbutyl]acetamide CAS Name: 2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-N-[(2S)-pentan-2-yl]acetamide IUPAC Name: 2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-[(2S)-pentan-2-yl]acetamide Traditional Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-N-[(1S)-1-methylbutyl]acetamide Formula: C20H30N4O4S2 MolecularWeight: 454.6066

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC[C@H](C)NC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H30N4O4S2/c1-4-6-15(3)21-19(25)14-29-20-22-17-13-16(7-8-18(17)24(20)5-2)30(26,27)23-9-11-28-12-10-23/h7-8,13,15H,4-6,9-12,14H2,1-3H3,(H,21,25)/t15-/m0/s1