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

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methoxycarbonylphenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methoxycarbonylbenzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[(4-methoxycarbonylphenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methoxycarbonylbenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 2-[(4-carbomethoxybenzoyl)amino]-4-methyl-5-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H23NO7S MolecularWeight: 481.51762

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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(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H23NO7S/c1-4-31-25(29)21-14(2)20(12-15-5-10-18-19(11-15)33-13-32-18)34-23(21)26-22(27)16-6-8-17(9-7-16)24(28)30-3/h5-11H,4,12-13H2,1-3H3,(H,26,27)