5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[4-(phenylcarbonyl)phenyl]carbonylamino]thiophene-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[4-(phenylcarbonyl)phenyl]carbonylamino]thiophene-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[(4-benzoylbenzoyl)amino]-4-methyl-thiophene-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[(4-benzoylphenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[(4-benzoylbenzoyl)amino]-4-methylthiophene-3-carboxamide Traditional Name: 2-[(4-benzoylbenzoyl)amino]-4-methyl-5-piperonyl-thiophene-3-carboxamide Formula: C28H22N2O5S MolecularWeight: 498.54968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H22N2O5S/c1-16-23(14-17-7-12-21-22(13-17)35-15-34-21)36-28(24(16)26(29)32)30-27(33)20-10-8-19(9-11-20)25(31)18-5-3-2-4-6-18/h2-13H,14-15H2,1H3,(H2,29,32)(H,30,33)