ethyl 2-[2-[(4-ethyl-5-methyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[2-[(4-ethyl-5-methyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[[2-[(4-ethyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-[(4-ethyl-5-methyl-1H-imidazol-2-yl)thio]-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-ethyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-[(4-ethyl-5-methyl-1H-imidazol-2-yl)thio]acetyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C18H20N4O3S2 MolecularWeight: 404.5064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=N1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCC)C

Isomeric SMILES

CCC1=C(NC(=N1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OCC)C

InChI

InChI=1S/C18H20N4O3S2/c1-4-12-10(3)19-17(20-12)26-9-15(23)22-18-21-13-7-6-11(8-14(13)27-18)16(24)25-5-2/h6-8H,4-5,9H2,1-3H3,(H,19,20)(H,21,22,23)