N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-2-[(1-phenethyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(1-phenethylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-methyl-2-[(1-phenethylbenzimidazol-2-yl)thio]propionamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1CCS(=O)(=O)C1)SC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N(C)C1CCS(=O)(=O)C1)SC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3S2/c1-17(22(27)25(2)19-13-15-31(28,29)16-19)30-23-24-20-10-6-7-11-21(20)26(23)14-12-18-8-4-3-5-9-18/h3-11,17,19H,12-16H2,1-2H3