methyl 4-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-5-propan-2-yl-thiophen-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-5-propan-2-yl-thiophen-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-5-isopropyl-2-thienyl]carbamoyl]benzoate CAS Name: 4-[[[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-5-propan-2-yl-2-thiophenyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-5-propan-2-ylthiophen-2-yl]carbamoyl]benzoate Traditional Name: 4-[[5-isopropyl-3-(piperonylcarbamoyl)-2-thienyl]carbamoyl]benzoic acid methyl ester Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C2=CC=C(C=C2)C(=O)OC)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)C2=CC=C(C=C2)C(=O)OC)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H24N2O6S/c1-14(2)21-11-18(23(29)26-12-15-4-9-19-20(10-15)33-13-32-19)24(34-21)27-22(28)16-5-7-17(8-6-16)25(30)31-3/h4-11,14H,12-13H2,1-3H3,(H,26,29)(H,27,28)