1-[[2-(1-benzothiophen-2-yl)pyrimidin-4-yl]amino]butan-2-ol

Systemtic Name: 1-[[2-(1-benzothiophen-2-yl)pyrimidin-4-yl]amino]butan-2-ol Openeye Name: 1-[[2-(benzothiophen-2-yl)pyrimidin-4-yl]amino]butan-2-ol CAS Name: 1-[[2-(1-benzothiophen-2-yl)-4-pyrimidinyl]amino]-2-butanol IUPAC Name: 1-[[2-(1-benzothiophen-2-yl)pyrimidin-4-yl]amino]butan-2-ol Traditional Name: 1-[[2-(benzothiophen-2-yl)pyrimidin-4-yl]amino]butan-2-ol Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC1=NC(=NC=C1)C2=CC3=CC=CC=C3S2)O

Isomeric SMILES

CCC(CNC1=NC(=NC=C1)C2=CC3=CC=CC=C3S2)O

InChI

InChI=1S/C16H17N3OS/c1-2-12(20)10-18-15-7-8-17-16(19-15)14-9-11-5-3-4-6-13(11)21-14/h3-9,12,20H,2,10H2,1H3,(H,17,18,19)