N-(3-butoxyphenyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(3-butoxyphenyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(3-butoxyphenyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-(3-butoxyphenyl)-2-(2-quinolinylthio)acetamide IUPAC Name: N-(3-butoxyphenyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(3-butoxyphenyl)-2-(2-quinolylthio)acetamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCOC1=CC=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H22N2O2S/c1-2-3-13-25-18-9-6-8-17(14-18)22-20(24)15-26-21-12-11-16-7-4-5-10-19(16)23-21/h4-12,14H,2-3,13,15H2,1H3,(H,22,24)