N-(3-chloranyl-4-methyl-phenyl)-3-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-3-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-3-[(3-cyano-6-isopropyl-2-pyridyl)sulfanyl]propanamide CAS Name: N-(3-chloro-4-methylphenyl)-3-[(3-cyano-6-propan-2-yl-2-pyridinyl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-3-(3-cyano-6-propan-2-ylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-3-[(3-cyano-6-isopropyl-2-pyridyl)thio]propionamide Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCSC2=C(C=CC(=N2)C(C)C)C#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCSC2=C(C=CC(=N2)C(C)C)C#N)Cl

InChI

InChI=1S/C19H20ClN3OS/c1-12(2)17-7-5-14(11-21)19(23-17)25-9-8-18(24)22-15-6-4-13(3)16(20)10-15/h4-7,10,12H,8-9H2,1-3H3,(H,22,24)