4-[(1R)-3-(2-hydroxyethylamino)-1-(1,2-oxazol-5-yl)propyl]sulfanyl-6-methoxy-pyridine-3-carbonitrile

Systemtic Name: 4-[(1R)-3-(2-hydroxyethylamino)-1-(1,2-oxazol-5-yl)propyl]sulfanyl-6-methoxy-pyridine-3-carbonitrile Openeye Name: 4-[(1R)-3-(2-hydroxyethylamino)-1-isoxazol-5-yl-propyl]sulfanyl-6-methoxy-pyridine-3-carbonitrile CAS Name: 4-[[(1R)-3-(2-hydroxyethylamino)-1-(5-isoxazolyl)propyl]thio]-6-methoxy-3-pyridinecarbonitrile IUPAC Name: 4-[(1R)-3-(2-hydroxyethylamino)-1-(1,2-oxazol-5-yl)propyl]sulfanyl-6-methoxypyridine-3-carbonitrile Traditional Name: 4-[[(1R)-3-(2-hydroxyethylamino)-1-isoxazol-5-yl-propyl]thio]-6-methoxy-nicotinonitrile Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C(=C1)SC(CCNCCO)C2=CC=NO2)C#N

Isomeric SMILES

COC1=NC=C(C(=C1)S[C@H](CCNCCO)C2=CC=NO2)C#N

InChI

InChI=1S/C15H18N4O3S/c1-21-15-8-14(11(9-16)10-18-15)23-13(3-4-17-6-7-20)12-2-5-19-22-12/h2,5,8,10,13,17,20H,3-4,6-7H2,1H3/t13-/m1/s1