(E)-3-(6-methyl-3-pentyl-1-benzothiophen-2-yl)-N-(5-pyridin-3-ylpentan-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(6-methyl-3-pentyl-1-benzothiophen-2-yl)-N-(5-pyridin-3-ylpentan-2-yl)prop-2-enamide Openeye Name: (E)-3-(6-methyl-3-pentyl-benzothiophen-2-yl)-N-[1-methyl-4-(3-pyridyl)butyl]prop-2-enamide CAS Name: (E)-3-(6-methyl-3-pentyl-1-benzothiophen-2-yl)-N-[5-(3-pyridinyl)pentan-2-yl]-2-propenamide IUPAC Name: (E)-3-(6-methyl-3-pentyl-1-benzothiophen-2-yl)-N-(5-pyridin-3-ylpentan-2-yl)prop-2-enamide Traditional Name: (E)-3-(3-amyl-6-methyl-benzothiophen-2-yl)-N-[1-methyl-4-(3-pyridyl)butyl]acrylamide Formula: C27H34N2OS MolecularWeight: 434.63666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(SC2=C1C=CC(=C2)C)C=CC(=O)NC(C)CCCC3=CN=CC=C3

Isomeric SMILES

CCCCCC1=C(SC2=C1C=CC(=C2)C)/C=C/C(=O)NC(C)CCCC3=CN=CC=C3

InChI

InChI=1S/C27H34N2OS/c1-4-5-6-12-23-24-14-13-20(2)18-26(24)31-25(23)15-16-27(30)29-21(3)9-7-10-22-11-8-17-28-19-22/h8,11,13-19,21H,4-7,9-10,12H2,1-3H3,(H,29,30)/b16-15+