ethyl 2-[2-(6-chloranylbenzotriazol-1-yl)oxyethanoylamino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(6-chloranylbenzotriazol-1-yl)oxyethanoylamino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-[(6-chloro-1-benzotriazolyl)oxy]-1-oxoethyl]amino]-5-methyl-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]amino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H21ClN4O4S MolecularWeight: 484.95524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CON3C4=C(C=CC(=C4)Cl)N=N3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CON3C4=C(C=CC(=C4)Cl)N=N3

InChI

InChI=1S/C23H21ClN4O4S/c1-4-31-23(30)21-20(15-7-5-13(2)6-8-15)14(3)33-22(21)25-19(29)12-32-28-18-11-16(24)9-10-17(18)26-27-28/h5-11H,4,12H2,1-3H3,(H,25,29)