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

Systemtic Name: methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(4-dimethylaminophenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(dimethylamino)benzoyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[(4-dimethylaminophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(dimethylamino)benzoyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 2-[[4-(dimethylamino)benzoyl]amino]-4-methyl-5-piperonyl-thiophene-3-carboxylic acid methyl ester Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)N(C)C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)N(C)C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H24N2O5S/c1-14-20(12-15-5-10-18-19(11-15)31-13-30-18)32-23(21(14)24(28)29-4)25-22(27)16-6-8-17(9-7-16)26(2)3/h5-11H,12-13H2,1-4H3,(H,25,27)