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

Systemtic Name: methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromanylthiophen-2-yl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromothiophene-2-carbonyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(5-bromothiophene-2-carbonyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 2-[(5-bromothiophene-2-carbonyl)amino]-4-methyl-5-piperonyl-thiophene-3-carboxylic acid methyl ester Formula: C20H16BrNO5S2 MolecularWeight: 494.37874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(S2)Br)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(S2)Br)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H16BrNO5S2/c1-10-15(8-11-3-4-12-13(7-11)27-9-26-12)29-19(17(10)20(24)25-2)22-18(23)14-5-6-16(21)28-14/h3-7H,8-9H2,1-2H3,(H,22,23)