N-[3-[[(4-methylpyridin-2-yl)amino]-phenyl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[3-[[(4-methylpyridin-2-yl)amino]-phenyl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[[(4-methyl-2-pyridyl)amino]-phenyl-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: N-[3-[[(4-methyl-2-pyridinyl)amino]-phenylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: N-[3-[[(4-methylpyridin-2-yl)amino]-phenylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[[(4-methyl-2-pyridyl)amino]-phenyl-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C26H25N3O2S MolecularWeight: 443.5606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(C2=CC=CC=C2)C3=C(SC4=C3CCCC4)NC(=O)C5=CC=CO5

Isomeric SMILES

CC1=CC(=NC=C1)NC(C2=CC=CC=C2)C3=C(SC4=C3CCCC4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C26H25N3O2S/c1-17-13-14-27-22(16-17)28-24(18-8-3-2-4-9-18)23-19-10-5-6-12-21(19)32-26(23)29-25(30)20-11-7-15-31-20/h2-4,7-9,11,13-16,24H,5-6,10,12H2,1H3,(H,27,28)(H,29,30)