7-chloranyl-4-(4,6-diethylpyrimidin-2-yl)sulfanyl-quinoline

Systemtic Name: 7-chloranyl-4-(4,6-diethylpyrimidin-2-yl)sulfanyl-quinoline Openeye Name: 7-chloro-4-(4,6-diethylpyrimidin-2-yl)sulfanyl-quinoline CAS Name: 7-chloro-4-[(4,6-diethyl-2-pyrimidinyl)thio]quinoline IUPAC Name: 7-chloro-4-(4,6-diethylpyrimidin-2-yl)sulfanylquinoline Traditional Name: 7-chloro-4-[(4,6-diethylpyrimidin-2-yl)thio]quinoline Formula: C17H16ClN3S MolecularWeight: 329.84704

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SC2=C3C=CC(=CC3=NC=C2)Cl)CC

Isomeric SMILES

CCC1=CC(=NC(=N1)SC2=C3C=CC(=CC3=NC=C2)Cl)CC

InChI

InChI=1S/C17H16ClN3S/c1-3-12-10-13(4-2)21-17(20-12)22-16-7-8-19-15-9-11(18)5-6-14(15)16/h5-10H,3-4H2,1-2H3