[2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 1-ethylbenzotriazole-5-carboxylate Openeye Name: [2-[2-(2-methoxyanilino)-2-oxo-ethyl]thiazol-4-yl]methyl 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [2-[2-(2-methoxyanilino)-2-oxoethyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[2-(2-methoxyanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [2-[2-keto-2-(o-anisidino)ethyl]thiazol-4-yl]methyl ester Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC3=CSC(=N3)CC(=O)NC4=CC=CC=C4OC)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC3=CSC(=N3)CC(=O)NC4=CC=CC=C4OC)N=N1

InChI

InChI=1S/C22H21N5O4S/c1-3-27-18-9-8-14(10-17(18)25-26-27)22(29)31-12-15-13-32-21(23-15)11-20(28)24-16-6-4-5-7-19(16)30-2/h4-10,13H,3,11-12H2,1-2H3,(H,24,28)