ethyl 1-ethyl-2-[2-[(5-nitro-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-[(5-nitro-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-[(5-nitrothiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-[(5-nitro-2-thiazolyl)amino]-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-[(5-nitro-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-keto-2-[(5-nitrothiazol-2-yl)amino]ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C17H17N5O5S2 MolecularWeight: 435.47738

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O5S2/c1-3-21-12-6-5-10(15(24)27-4-2)7-11(12)19-17(21)28-9-13(23)20-16-18-8-14(29-16)22(25)26/h5-8H,3-4,9H2,1-2H3,(H,18,20,23)