2-(2-azanylpyrimidin-4-yl)-3-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]-1-benzothiophene-5-carboxamide

Systemtic Name: 2-(2-azanylpyrimidin-4-yl)-3-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]-1-benzothiophene-5-carboxamide Openeye Name: 2-(2-aminopyrimidin-4-yl)-3-methyl-N-[4-(2-morpholinoethoxy)phenyl]benzothiophene-5-carboxamide CAS Name: 2-(2-amino-4-pyrimidinyl)-3-methyl-N-[4-[2-(4-morpholinyl)ethoxy]phenyl]-1-benzothiophene-5-carboxamide IUPAC Name: 2-(2-aminopyrimidin-4-yl)-3-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]-1-benzothiophene-5-carboxamide Traditional Name: 2-(2-aminopyrimidin-4-yl)-3-methyl-N-[4-(2-morpholinoethoxy)phenyl]benzothiophene-5-carboxamide Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)OCCN4CCOCC4)C5=NC(=NC=C5)N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)OCCN4CCOCC4)C5=NC(=NC=C5)N

InChI

InChI=1S/C26H27N5O3S/c1-17-21-16-18(2-7-23(21)35-24(17)22-8-9-28-26(27)30-22)25(32)29-19-3-5-20(6-4-19)34-15-12-31-10-13-33-14-11-31/h2-9,16H,10-15H2,1H3,(H,29,32)(H2,27,28,30)