N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2-pentylsulfanylbenzimidazol-1-yl)ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(2-pentylsulfanylbenzimidazol-1-yl)ethanamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(2-pentylsulfanylbenzimidazol-1-yl)acetamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[2-(pentylthio)-1-benzimidazolyl]acetamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(2-pentylsulfanylbenzimidazol-1-yl)acetamide Traditional Name: 2-[2-(amylthio)benzimidazol-1-yl]-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=CC=CC=C2N1CC(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CCCCCSC1=NC2=CC=CC=C2N1CC(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C18H25N3O3S2/c1-2-3-6-10-25-18-20-15-7-4-5-8-16(15)21(18)12-17(22)19-14-9-11-26(23,24)13-14/h4-5,7-8,14H,2-3,6,9-13H2,1H3,(H,19,22)/t14-/m0/s1