6-[[2-(2-azanylpyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]amino]-1H-pyrimidin-2-one

Systemtic Name: 6-[[2-(2-azanylpyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]amino]-1H-pyrimidin-2-one Openeye Name: 6-[[2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]amino]-1H-pyrimidin-2-one CAS Name: 6-[[2-(2-amino-4-pyrimidinyl)-3-methyl-1-benzothiophen-5-yl]amino]-1H-pyrimidin-2-one IUPAC Name: 6-[[2-(2-aminopyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]amino]-1H-pyrimidin-2-one Traditional Name: 6-[[2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]amino]-1H-pyrimidin-2-one Formula: C17H14N6OS MolecularWeight: 350.39766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)NC3=CC=NC(=O)N3)C4=NC(=NC=C4)N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)NC3=CC=NC(=O)N3)C4=NC(=NC=C4)N

InChI

InChI=1S/C17H14N6OS/c1-9-11-8-10(21-14-5-7-20-17(24)23-14)2-3-13(11)25-15(9)12-4-6-19-16(18)22-12/h2-8H,1H3,(H2,18,19,22)(H2,20,21,23,24)