S-[2-[4-[(1-methylbenzimidazol-5-yl)sulfonylamino]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[(1-methylbenzimidazol-5-yl)sulfonylamino]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-[(1-methylbenzimidazol-5-yl)sulfonylamino]phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[(1-methyl-5-benzimidazolyl)sulfonylamino]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[(1-methylbenzimidazol-5-yl)sulfonylamino]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[4-[(1-methylbenzimidazol-5-yl)sulfonylamino]phenyl]ethyl] ester Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C=N3)C

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C=N3)C

InChI

InChI=1S/C18H17N3O4S2/c1-12(22)26-10-18(23)13-3-5-14(6-4-13)20-27(24,25)15-7-8-17-16(9-15)19-11-21(17)2/h3-9,11,20H,10H2,1-2H3