6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-N-cyclopropyl-2-methyl-pyrimidin-4-amine

Systemtic Name: 6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-N-cyclopropyl-2-methyl-pyrimidin-4-amine Openeye Name: 6-[5-(benzothiophen-2-yl)-3-pyridyl]-N-cyclopropyl-2-methyl-pyrimidin-4-amine CAS Name: 6-[5-(1-benzothiophen-2-yl)-3-pyridinyl]-N-cyclopropyl-2-methyl-4-pyrimidinamine IUPAC Name: 6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-N-cyclopropyl-2-methylpyrimidin-4-amine Traditional Name: [6-[5-(benzothiophen-2-yl)-3-pyridyl]-2-methyl-pyrimidin-4-yl]-cyclopropyl-amine Formula: C21H18N4S MolecularWeight: 358.45942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2CC2)C3=CC(=CN=C3)C4=CC5=CC=CC=C5S4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2CC2)C3=CC(=CN=C3)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C21H18N4S/c1-13-23-18(10-21(24-13)25-17-6-7-17)15-8-16(12-22-11-15)20-9-14-4-2-3-5-19(14)26-20/h2-5,8-12,17H,6-7H2,1H3,(H,23,24,25)