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

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(3-phenoxyphenyl)carbonylamino]thiophene-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(3-phenoxybenzoyl)amino]thiophene-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[oxo-(3-phenoxyphenyl)methyl]amino]-3-thiophenecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(3-phenoxybenzoyl)amino]thiophene-3-carboxamide Traditional Name: 4-methyl-2-[(3-phenoxybenzoyl)amino]-5-piperonyl-thiophene-3-carboxamide Formula: C27H22N2O5S MolecularWeight: 486.53898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H22N2O5S/c1-16-23(13-17-10-11-21-22(12-17)33-15-32-21)35-27(24(16)25(28)30)29-26(31)18-6-5-9-20(14-18)34-19-7-3-2-4-8-19/h2-12,14H,13,15H2,1H3,(H2,28,30)(H,29,31)