N,N-dimethyl-2-[4-(1-methylpyrrol-2-yl)pyrimidin-2-yl]sulfanyl-ethanamine

Systemtic Name: N,N-dimethyl-2-[4-(1-methylpyrrol-2-yl)pyrimidin-2-yl]sulfanyl-ethanamine Openeye Name: N,N-dimethyl-2-[4-(1-methylpyrrol-2-yl)pyrimidin-2-yl]sulfanyl-ethanamine CAS Name: N,N-dimethyl-2-[[4-(1-methyl-2-pyrrolyl)-2-pyrimidinyl]thio]ethanamine IUPAC Name: N,N-dimethyl-2-[4-(1-methylpyrrol-2-yl)pyrimidin-2-yl]sulfanylethanamine Traditional Name: dimethyl-[2-[[4-(1-methylpyrrol-2-yl)pyrimidin-2-yl]thio]ethyl]amine Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NC(=NC=C2)SCCN(C)C

Isomeric SMILES

CN1C=CC=C1C2=NC(=NC=C2)SCCN(C)C

InChI

InChI=1S/C13H18N4S/c1-16(2)9-10-18-13-14-7-6-11(15-13)12-5-4-8-17(12)3/h4-8H,9-10H2,1-3H3