2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-ethyl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-ethyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl-ethyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[2-chloro-7-(methylthio)-3-quinolinyl]methyl-ethylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl-ethylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[2-chloro-7-(methylthio)-3-quinolyl]methyl-ethyl-amino]-N-(2-thenyl)acetamide Formula: C20H22ClN3OS2 MolecularWeight: 419.99118

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CCN(CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H22ClN3OS2/c1-3-24(13-19(25)22-11-17-5-4-8-27-17)12-15-9-14-6-7-16(26-2)10-18(14)23-20(15)21/h4-10H,3,11-13H2,1-2H3,(H,22,25)