ethyl 2-[[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]amino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[4-(4-sec-butylphenyl)thiazol-2-yl]amino]thiophene-3-carboxylate CAS Name: 2-[[4-(4-butan-2-ylphenyl)-2-thiazolyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[4-(4-sec-butylphenyl)thiazol-2-yl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H26N2O2S2 MolecularWeight: 414.58404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC3=C(C(=C(S3)C)C)C(=O)OCC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC3=C(C(=C(S3)C)C)C(=O)OCC

InChI

InChI=1S/C22H26N2O2S2/c1-6-13(3)16-8-10-17(11-9-16)18-12-27-22(23-18)24-20-19(21(25)26-7-2)14(4)15(5)28-20/h8-13H,6-7H2,1-5H3,(H,23,24)