N-(3-chloranyl-4-ethylsulfanyl-phenyl)quinoline-2-carboxamide

Systemtic Name: N-(3-chloranyl-4-ethylsulfanyl-phenyl)quinoline-2-carboxamide Openeye Name: N-(3-chloro-4-ethylsulfanyl-phenyl)quinoline-2-carboxamide CAS Name: N-[3-chloro-4-(ethylthio)phenyl]-2-quinolinecarboxamide IUPAC Name: N-(3-chloro-4-ethylsulfanylphenyl)quinoline-2-carboxamide Traditional Name: N-[3-chloro-4-(ethylthio)phenyl]quinaldamide Formula: C18H15ClN2OS MolecularWeight: 342.8425

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C(C=C1)NC(=O)C2=NC3=CC=CC=C3C=C2)Cl

Isomeric SMILES

CCSC1=C(C=C(C=C1)NC(=O)C2=NC3=CC=CC=C3C=C2)Cl

InChI

InChI=1S/C18H15ClN2OS/c1-2-23-17-10-8-13(11-14(17)19)20-18(22)16-9-7-12-5-3-4-6-15(12)21-16/h3-11H,2H2,1H3,(H,20,22)