6-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-carbothioic S-acid

Systemtic Name: 6-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-carbothioic S-acid Openeye Name: 6-[4-[allyl(methyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-carbothioic S-acid CAS Name: 6-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-carbothioic S-acid IUPAC Name: 6-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-carbothioic S-acid Traditional Name: 6-[4-[allyl(methyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-carbothioic S-acid Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCOC1=CC2=C(C=C1)N(CCC2)C(=O)S)CC=C

Isomeric SMILES

CN(CCCCOC1=CC2=C(C=C1)N(CCC2)C(=O)S)CC=C

InChI

InChI=1S/C18H26N2O2S/c1-3-10-19(2)11-4-5-13-22-16-8-9-17-15(14-16)7-6-12-20(17)18(21)23/h3,8-9,14H,1,4-7,10-13H2,2H3,(H,21,23)