N-(3-chloranyl-4-methyl-phenyl)-3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanamide CAS Name: N-(3-chloro-4-methylphenyl)-3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-3-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]propionamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCSC2=NC3=C(CCCC3)C=C2C#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCSC2=NC3=C(CCCC3)C=C2C#N)Cl

InChI

InChI=1S/C20H20ClN3OS/c1-13-6-7-16(11-17(13)21)23-19(25)8-9-26-20-15(12-22)10-14-4-2-3-5-18(14)24-20/h6-7,10-11H,2-5,8-9H2,1H3,(H,23,25)