dimethyl-[2-[2-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)ethylcarbamothioylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[2-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)ethylcarbamothioylamino]ethyl]azanium Openeye Name: dimethyl-[2-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethylcarbamothioylamino]ethyl]ammonium CAS Name: dimethyl-[2-[[[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethylamino]-sulfanylidenemethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethylcarbamothioylamino]ethyl]azanium Traditional Name: 2-[2-(2-keto-7-methyl-1H-quinolin-3-yl)ethylthiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C17H25N4OS+ MolecularWeight: 333.4716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NCC[NH+](C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NCC[NH+](C)C

InChI

InChI=1S/C17H24N4OS/c1-12-4-5-13-11-14(16(22)20-15(13)10-12)6-7-18-17(23)19-8-9-21(2)3/h4-5,10-11H,6-9H2,1-3H3,(H,20,22)(H2,18,19,23)/p+1