N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-N-propyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-N-propyl-ethanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-N-propyl-acetamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-[[1-(2-methylphenyl)-2-imidazolyl]thio]-N-propylacetamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-N-propylacetamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-[[1-(o-tolyl)imidazol-2-yl]thio]-N-propyl-acetamide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC=CN2C3=CC=CC=C3C

Isomeric SMILES

CCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC=CN2C3=CC=CC=C3C

InChI

InChI=1S/C19H25N3O3S2/c1-3-10-21(16-8-12-27(24,25)14-16)18(23)13-26-19-20-9-11-22(19)17-7-5-4-6-15(17)2/h4-7,9,11,16H,3,8,10,12-14H2,1-2H3