N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-butyl-N-(1,1-dioxo-3-thiolanyl)-2-[(1-methyl-5-phenyl-2-imidazolyl)thio]acetamide IUPAC Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetamide Traditional Name: N-butyl-N-(1,1-diketothiolan-3-yl)-2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC=C(N2C)C3=CC=CC=C3

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC=C(N2C)C3=CC=CC=C3

InChI

InChI=1S/C20H27N3O3S2/c1-3-4-11-23(17-10-12-28(25,26)15-17)19(24)14-27-20-21-13-18(22(20)2)16-8-6-5-7-9-16/h5-9,13,17H,3-4,10-12,14-15H2,1-2H3