1-(1,3-benzodioxol-5-yl)-N-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-N-methyl-methanamine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-N-methyl-methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl]-N-methyl-methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[[2-chloro-7-(methylthio)-3-quinolinyl]methyl]-N-methylmethanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl]-N-methylmethanamine Traditional Name: [2-chloro-7-(methylthio)-3-quinolyl]methyl-methyl-piperonyl-amine Formula: C20H19ClN2O2S MolecularWeight: 386.89506

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)CC3=C(N=C4C=C(C=CC4=C3)SC)Cl

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)CC3=C(N=C4C=C(C=CC4=C3)SC)Cl

InChI

InChI=1S/C20H19ClN2O2S/c1-23(10-13-3-6-18-19(7-13)25-12-24-18)11-15-8-14-4-5-16(26-2)9-17(14)22-20(15)21/h3-9H,10-12H2,1-2H3