N-[1-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-benzyl-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[1-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-benzyl-2-keto-2-[methyl(piperonyl)amino]ethyl]thiophene-2-carboxamide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H22N2O4S/c1-25(14-17-9-10-19-20(13-17)29-15-28-19)23(27)18(12-16-6-3-2-4-7-16)24-22(26)21-8-5-11-30-21/h2-11,13,18H,12,14-15H2,1H3,(H,24,26)