N-[3-(benzimidazol-1-yl)propyl]-2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-benzamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-benzamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-2-(1,1-dioxothiolan-3-yl)sulfanyl-benzamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-2-[(1,1-dioxo-3-thiolanyl)thio]benzamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-2-(1,1-dioxothiolan-3-yl)sulfanylbenzamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-2-[(1,1-diketothiolan-3-yl)thio]benzamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1SC2=CC=CC=C2C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

C1CS(=O)(=O)CC1SC2=CC=CC=C2C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H23N3O3S2/c25-21(22-11-5-12-24-15-23-18-7-2-3-8-19(18)24)17-6-1-4-9-20(17)28-16-10-13-29(26,27)14-16/h1-4,6-9,15-16H,5,10-14H2,(H,22,25)