N-[(1-methyl-6-oxidanylidene-4-pyrimidin-4-yl-pyrimidin-2-yl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(1-methyl-6-oxidanylidene-4-pyrimidin-4-yl-pyrimidin-2-yl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[(1-methyl-6-oxo-4-pyrimidin-4-yl-pyrimidin-2-yl)methyl]benzothiophene-2-carboxamide CAS Name: N-[[1-methyl-6-oxo-4-(4-pyrimidinyl)-2-pyrimidinyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1-methyl-6-oxo-4-pyrimidin-4-ylpyrimidin-2-yl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[[6-keto-1-methyl-4-(4-pyrimidyl)pyrimidin-2-yl]methyl]benzothiophene-2-carboxamide Formula: C19H15N5O2S MolecularWeight: 377.4197

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1CNC(=O)C2=CC3=CC=CC=C3S2)C4=NC=NC=C4

Isomeric SMILES

CN1C(=O)C=C(N=C1CNC(=O)C2=CC3=CC=CC=C3S2)C4=NC=NC=C4

InChI

InChI=1S/C19H15N5O2S/c1-24-17(23-14(9-18(24)25)13-6-7-20-11-22-13)10-21-19(26)16-8-12-4-2-3-5-15(12)27-16/h2-9,11H,10H2,1H3,(H,21,26)