2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(1,1-dioxothiolan-3-yl)-5-methyl-pyrazol-3-yl]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[2-(1,1-dioxo-3-thiolanyl)-5-methyl-3-pyrazolyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[2-(1,1-diketothiolan-3-yl)-5-methyl-pyrazol-3-yl]acetamide Formula: C17H19N5O3S2 MolecularWeight: 405.49446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3N2)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3N2)C4CCS(=O)(=O)C4

InChI

InChI=1S/C17H19N5O3S2/c1-11-8-15(22(21-11)12-6-7-27(24,25)10-12)20-16(23)9-26-17-18-13-4-2-3-5-14(13)19-17/h2-5,8,12H,6-7,9-10H2,1H3,(H,18,19)(H,20,23)