N-[3-[1,3-benzodioxol-5-yl-[(6-methylpyridin-2-yl)amino]methyl]-5-ethyl-thiophen-2-yl]benzamide

Systemtic Name: N-[3-[1,3-benzodioxol-5-yl-[(6-methylpyridin-2-yl)amino]methyl]-5-ethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[1,3-benzodioxol-5-yl-[(6-methyl-2-pyridyl)amino]methyl]-5-ethyl-2-thienyl]benzamide CAS Name: N-[3-[1,3-benzodioxol-5-yl-[(6-methyl-2-pyridinyl)amino]methyl]-5-ethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[1,3-benzodioxol-5-yl-[(6-methylpyridin-2-yl)amino]methyl]-5-ethylthiophen-2-yl]benzamide Traditional Name: N-[3-[1,3-benzodioxol-5-yl-[(6-methyl-2-pyridyl)amino]methyl]-5-ethyl-2-thienyl]benzamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC4=C(C=C3)OCO4)NC5=CC=CC(=N5)C

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC4=C(C=C3)OCO4)NC5=CC=CC(=N5)C

InChI

InChI=1S/C27H25N3O3S/c1-3-20-15-21(27(34-20)30-26(31)18-9-5-4-6-10-18)25(29-24-11-7-8-17(2)28-24)19-12-13-22-23(14-19)33-16-32-22/h4-15,25H,3,16H2,1-2H3,(H,28,29)(H,30,31)