ethyl 4-(4-butylphenyl)-2-[(2,5-dimethylfuran-3-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-butylphenyl)-2-[(2,5-dimethylfuran-3-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(4-butylphenyl)-2-[(2,5-dimethylfuran-3-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-butylphenyl)-2-[[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butylphenyl)-2-[(2,5-dimethylfuran-3-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(4-butylphenyl)-2-[(2,5-dimethyl-3-furoyl)amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H29NO4S MolecularWeight: 439.56706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)NC(=O)C3=C(OC(=C3)C)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCC)NC(=O)C3=C(OC(=C3)C)C)C

InChI

InChI=1S/C25H29NO4S/c1-6-8-9-18-10-12-19(13-11-18)21-17(5)31-24(22(21)25(28)29-7-2)26-23(27)20-14-15(3)30-16(20)4/h10-14H,6-9H2,1-5H3,(H,26,27)