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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclohexyl-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-N-(1,1-dioxothiolan-3-yl)-2-[1-(m-tolyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-cyclohexyl-N-(1,1-dioxo-3-thiolanyl)-2-[[1-(3-methylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-cyclohexyl-N-(1,1-dioxothiolan-3-yl)-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-cyclohexyl-N-(1,1-diketothiolan-3-yl)-2-[[1-(m-tolyl)imidazol-2-yl]thio]acetamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2SCC(=O)N(C3CCCCC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2SCC(=O)N(C3CCCCC3)C4CCS(=O)(=O)C4

InChI

InChI=1S/C22H29N3O3S2/c1-17-6-5-9-19(14-17)24-12-11-23-22(24)29-15-21(26)25(18-7-3-2-4-8-18)20-10-13-30(27,28)16-20/h5-6,9,11-12,14,18,20H,2-4,7-8,10,13,15-16H2,1H3