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

Systemtic Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide Openeye Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]acetamide CAS Name: 2-[(1-hexyl-2-benzimidazolyl)thio]-N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]acetamide Traditional Name: N-[(3S)-1,1-diketo-3-methyl-thiolan-3-yl]-2-[(1-hexylbenzimidazol-2-yl)thio]acetamide Formula: C20H29N3O3S2 MolecularWeight: 423.59256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3(CCS(=O)(=O)C3)C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)N[C@]3(CCS(=O)(=O)C3)C

InChI

InChI=1S/C20H29N3O3S2/c1-3-4-5-8-12-23-17-10-7-6-9-16(17)21-19(23)27-14-18(24)22-20(2)11-13-28(25,26)15-20/h6-7,9-10H,3-5,8,11-15H2,1-2H3,(H,22,24)/t20-/m0/s1