2-chloroethyl 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylbenzimidazole-1-carboxylate

Systemtic Name: 2-chloroethyl 2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanylbenzimidazole-1-carboxylate Openeye Name: 2-chloroethyl 2-[2-(diethylamino)-2-oxo-ethyl]sulfanylbenzimidazole-1-carboxylate CAS Name: 2-[[2-(diethylamino)-2-oxoethyl]thio]-1-benzimidazolecarboxylic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 2-[2-(diethylamino)-2-oxoethyl]sulfanylbenzimidazole-1-carboxylate Traditional Name: 2-[[2-(diethylamino)-2-keto-ethyl]thio]benzimidazole-1-carboxylic acid 2-chloroethyl ester Formula: C16H20ClN3O3S MolecularWeight: 369.8663

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC2=CC=CC=C2N1C(=O)OCCCl

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC2=CC=CC=C2N1C(=O)OCCCl

InChI

InChI=1S/C16H20ClN3O3S/c1-3-19(4-2)14(21)11-24-15-18-12-7-5-6-8-13(12)20(15)16(22)23-10-9-17/h5-8H,3-4,9-11H2,1-2H3