diethyl-[2-[3-(4-methylphenyl)-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl]azanium

Systemtic Name: diethyl-[2-[3-(4-methylphenyl)-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl]azanium Openeye Name: diethyl-[2-[3-(p-tolyl)-4-thioxo-1,3,5-triazinan-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[3-(4-methylphenyl)-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl]ammonium IUPAC Name: diethyl-[2-[3-(4-methylphenyl)-4-sulfanylidene-1,3,5-triazinan-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[3-(p-tolyl)-4-thioxo-1,3,5-triazinan-1-yl]ethyl]ammonium Formula: C16H27N4S+ MolecularWeight: 307.47738

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1CNC(=S)N(C1)C2=CC=C(C=C2)C

Isomeric SMILES

CC[NH+](CC)CCN1CNC(=S)N(C1)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H26N4S/c1-4-18(5-2)10-11-19-12-17-16(21)20(13-19)15-8-6-14(3)7-9-15/h6-9H,4-5,10-13H2,1-3H3,(H,17,21)/p+1