N-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-1-(3,4-dimethoxyphenyl)-N-methyl-methanamine

Systemtic Name: N-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-1-(3,4-dimethoxyphenyl)-N-methyl-methanamine Openeye Name: N-[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl]-1-(3,4-dimethoxyphenyl)-N-methyl-methanamine CAS Name: N-[[2-chloro-7-(methylthio)-3-quinolinyl]methyl]-1-(3,4-dimethoxyphenyl)-N-methylmethanamine IUPAC Name: N-[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl]-1-(3,4-dimethoxyphenyl)-N-methylmethanamine Traditional Name: [2-chloro-7-(methylthio)-3-quinolyl]methyl-methyl-veratryl-amine Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl

InChI

InChI=1S/C21H23ClN2O2S/c1-24(12-14-5-8-19(25-2)20(9-14)26-3)13-16-10-15-6-7-17(27-4)11-18(15)23-21(16)22/h5-11H,12-13H2,1-4H3