2-[[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]sulfanyl]ethyl-trimethyl-azanium

Systemtic Name: 2-[[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]sulfanyl]ethyl-trimethyl-azanium Openeye Name: 2-[[4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl]sulfanyl]ethyl-trimethyl-ammonium CAS Name: 2-[[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]thio]ethyl-trimethylammonium IUPAC Name: 2-[[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]sulfanyl]ethyl-trimethylazanium Traditional Name: 2-[[4-(ethylamino)-6-(isopropylamino)-s-triazin-2-yl]thio]ethyl-trimethyl-ammonium Formula: C13H27N6S+ MolecularWeight: 299.45868

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)SCC[N+](C)(C)C)NC(C)C

Isomeric SMILES

CCNC1=NC(=NC(=N1)SCC[N+](C)(C)C)NC(C)C

InChI

InChI=1S/C13H27N6S/c1-7-14-11-16-12(15-10(2)3)18-13(17-11)20-9-8-19(4,5)6/h10H,7-9H2,1-6H3,(H2,14,15,16,17,18)/q+1