3-[[2-(2-azanylpyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]methyl]-N-[4-(2-piperidin-1-ylethoxy)phenyl]benzamide

Systemtic Name: 3-[[2-(2-azanylpyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]methyl]-N-[4-(2-piperidin-1-ylethoxy)phenyl]benzamide Openeye Name: 3-[[2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]methyl]-N-[4-[2-(1-piperidyl)ethoxy]phenyl]benzamide CAS Name: 3-[[2-(2-amino-4-pyrimidinyl)-3-methyl-1-benzothiophen-5-yl]methyl]-N-[4-[2-(1-piperidinyl)ethoxy]phenyl]benzamide IUPAC Name: 3-[[2-(2-aminopyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]methyl]-N-[4-(2-piperidin-1-ylethoxy)phenyl]benzamide Traditional Name: 3-[[2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]methyl]-N-[4-(2-piperidinoethoxy)phenyl]benzamide Formula: C34H35N5O2S MolecularWeight: 577.739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)CC3=CC=CC(=C3)C(=O)NC4=CC=C(C=C4)OCCN5CCCCC5)C6=NC(=NC=C6)N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)CC3=CC=CC(=C3)C(=O)NC4=CC=C(C=C4)OCCN5CCCCC5)C6=NC(=NC=C6)N

InChI

InChI=1S/C34H35N5O2S/c1-23-29-22-25(8-13-31(29)42-32(23)30-14-15-36-34(35)38-30)20-24-6-5-7-26(21-24)33(40)37-27-9-11-28(12-10-27)41-19-18-39-16-3-2-4-17-39/h5-15,21-22H,2-4,16-20H2,1H3,(H,37,40)(H2,35,36,38)