N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[2-(1,1-dioxo-3-thiolanyl)-5-methyl-3-pyrazolyl]-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[2-(1,1-diketothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C18H21N5O3S2 MolecularWeight: 419.52104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C)C4CCS(=O)(=O)C4

InChI

InChI=1S/C18H21N5O3S2/c1-12-9-16(23(21-12)13-7-8-28(25,26)11-13)20-17(24)10-27-18-19-14-5-3-4-6-15(14)22(18)2/h3-6,9,13H,7-8,10-11H2,1-2H3,(H,20,24)