2-[(1R,3S)-3-azanyl-4-oxidanyl-1-phenyl-butyl]sulfanyl-6-propan-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(1R,3S)-3-azanyl-4-oxidanyl-1-phenyl-butyl]sulfanyl-6-propan-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(1R,3S)-3-amino-4-hydroxy-1-phenyl-butyl]sulfanyl-6-isopropyl-pyridine-3-carbonitrile CAS Name: 2-[[(1R,3S)-3-amino-4-hydroxy-1-phenylbutyl]thio]-6-propan-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(1R,3S)-3-amino-4-hydroxy-1-phenylbutyl]sulfanyl-6-propan-2-ylpyridine-3-carbonitrile Traditional Name: 2-[[(1R,3S)-3-amino-4-hydroxy-1-phenyl-butyl]thio]-6-isopropyl-nicotinonitrile Formula: C19H23N3OS MolecularWeight: 341.47042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C(C=C1)C#N)SC(CC(CO)N)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=NC(=C(C=C1)C#N)S[C@H](C[C@@H](CO)N)C2=CC=CC=C2

InChI

InChI=1S/C19H23N3OS/c1-13(2)17-9-8-15(11-20)19(22-17)24-18(10-16(21)12-23)14-6-4-3-5-7-14/h3-9,13,16,18,23H,10,12,21H2,1-2H3/t16-,18+/m0/s1