5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioic S-acid

Systemtic Name: 5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioic S-acid Openeye Name: 5-[4-[allyl(methyl)amino]butoxy]indoline-1-carbothioic S-acid CAS Name: 5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioic S-acid IUPAC Name: 5-[4-[methyl(prop-2-enyl)amino]butoxy]-2,3-dihydroindole-1-carbothioic S-acid Traditional Name: 5-[4-[allyl(methyl)amino]butoxy]indoline-1-carbothioic S-acid Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O2S/c1-3-9-18(2)10-4-5-12-21-15-6-7-16-14(13-15)8-11-19(16)17(20)22/h3,6-7,13H,1,4-5,8-12H2,2H3,(H,20,22)