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

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]acetamide Formula: C18H15ClN4O3S MolecularWeight: 402.8547

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(C(=N2)SCC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2=C(C1)C=C(C(=N2)SCC(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H15ClN4O3S/c19-14-6-5-13(8-16(14)23(25)26)21-17(24)10-27-18-12(9-20)7-11-3-1-2-4-15(11)22-18/h5-8H,1-4,10H2,(H,21,24)