(E)-3-(2-azanylpyrimidin-5-yl)-N-(1-benzothiophen-2-ylmethyl)-N-methyl-prop-2-enamide

Systemtic Name: (E)-3-(2-azanylpyrimidin-5-yl)-N-(1-benzothiophen-2-ylmethyl)-N-methyl-prop-2-enamide Openeye Name: (E)-3-(2-aminopyrimidin-5-yl)-N-(benzothiophen-2-ylmethyl)-N-methyl-prop-2-enamide CAS Name: (E)-3-(2-amino-5-pyrimidinyl)-N-(1-benzothiophen-2-ylmethyl)-N-methyl-2-propenamide IUPAC Name: (E)-3-(2-aminopyrimidin-5-yl)-N-(1-benzothiophen-2-ylmethyl)-N-methylprop-2-enamide Traditional Name: (E)-3-(2-aminopyrimidin-5-yl)-N-(benzothiophen-2-ylmethyl)-N-methyl-acrylamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=CC=CC=C2S1)C(=O)C=CC3=CN=C(N=C3)N

Isomeric SMILES

CN(CC1=CC2=CC=CC=C2S1)C(=O)/C=C/C3=CN=C(N=C3)N

InChI

InChI=1S/C17H16N4OS/c1-21(11-14-8-13-4-2-3-5-15(13)23-14)16(22)7-6-12-9-19-17(18)20-10-12/h2-10H,11H2,1H3,(H2,18,19,20)/b7-6+