N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(2-methyl-1,3-thiazol-4-yl)pyrimidin-2-amine

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(2-methyl-1,3-thiazol-4-yl)pyrimidin-2-amine Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(2-methylthiazol-4-yl)pyrimidin-2-amine CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(2-methyl-4-thiazolyl)-2-pyrimidinamine IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(2-methyl-1,3-thiazol-4-yl)pyrimidin-2-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[4-(2-methylthiazol-4-yl)pyrimidin-2-yl]amine Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=NC(=NC=C2)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=NC(=CS1)C2=NC(=NC=C2)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C17H16N4O2S/c1-11-19-14(10-24-11)13-5-6-18-17(21-13)20-12-3-4-15-16(9-12)23-8-2-7-22-15/h3-6,9-10H,2,7-8H2,1H3,(H,18,20,21)