5-(1-benzothiophen-2-yl)-N-(2,2-dimethoxyethyl)pyrimidin-2-amine

Systemtic Name: 5-(1-benzothiophen-2-yl)-N-(2,2-dimethoxyethyl)pyrimidin-2-amine Openeye Name: 5-(benzothiophen-2-yl)-N-(2,2-dimethoxyethyl)pyrimidin-2-amine CAS Name: 5-(1-benzothiophen-2-yl)-N-(2,2-dimethoxyethyl)-2-pyrimidinamine IUPAC Name: 5-(1-benzothiophen-2-yl)-N-(2,2-dimethoxyethyl)pyrimidin-2-amine Traditional Name: [5-(benzothiophen-2-yl)pyrimidin-2-yl]-(2,2-dimethoxyethyl)amine Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC1=NC=C(C=N1)C2=CC3=CC=CC=C3S2)OC

Isomeric SMILES

COC(CNC1=NC=C(C=N1)C2=CC3=CC=CC=C3S2)OC

InChI

InChI=1S/C16H17N3O2S/c1-20-15(21-2)10-19-16-17-8-12(9-18-16)14-7-11-5-3-4-6-13(11)22-14/h3-9,15H,10H2,1-2H3,(H,17,18,19)