(2S)-2-(5-azanylpyridin-2-yl)sulfanyl-N-(3-chloranyl-4-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-(5-azanylpyridin-2-yl)sulfanyl-N-(3-chloranyl-4-methyl-phenyl)propanamide Openeye Name: (2S)-2-[(5-amino-2-pyridyl)sulfanyl]-N-(3-chloro-4-methyl-phenyl)propanamide CAS Name: (2S)-2-[(5-amino-2-pyridinyl)thio]-N-(3-chloro-4-methylphenyl)propanamide IUPAC Name: (2S)-2-(5-aminopyridin-2-yl)sulfanyl-N-(3-chloro-4-methylphenyl)propanamide Traditional Name: (2S)-2-[(5-amino-2-pyridyl)thio]-N-(3-chloro-4-methyl-phenyl)propionamide Formula: C15H16ClN3OS MolecularWeight: 321.82504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=C(C=C2)N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C)SC2=NC=C(C=C2)N)Cl

InChI

InChI=1S/C15H16ClN3OS/c1-9-3-5-12(7-13(9)16)19-15(20)10(2)21-14-6-4-11(17)8-18-14/h3-8,10H,17H2,1-2H3,(H,19,20)/t10-/m0/s1