N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: 2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C16H20ClN3O3S2 MolecularWeight: 401.9313

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C16H20ClN3O3S2/c1-2-6-20-14-4-3-11(17)8-13(14)19-16(20)24-9-15(21)18-12-5-7-25(22,23)10-12/h3-4,8,12H,2,5-7,9-10H2,1H3,(H,18,21)/t12-/m0/s1