N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-(2-quinolylsulfanyl)propanamide CAS Name: N-[4-(4-methoxyphenyl)-2-thiazolyl]-3-(2-quinolinylthio)propanamide IUPAC Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-quinolin-2-ylsulfanylpropanamide Traditional Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-(2-quinolylthio)propionamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H19N3O2S2/c1-27-17-9-6-16(7-10-17)19-14-29-22(24-19)25-20(26)12-13-28-21-11-8-15-4-2-3-5-18(15)23-21/h2-11,14H,12-13H2,1H3,(H,24,25,26)