ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylphenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylphenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylbenzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[(3,4-dimethylphenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylbenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 2-[(3,4-dimethylbenzoyl)amino]-4-methyl-5-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C25H25NO5S/c1-5-29-25(28)22-16(4)21(12-17-7-9-19-20(11-17)31-13-30-19)32-24(22)26-23(27)18-8-6-14(2)15(3)10-18/h6-11H,5,12-13H2,1-4H3,(H,26,27)