diethyl-[2-[[1-(2-methylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]ethyl]azanium

Systemtic Name: diethyl-[2-[[1-(2-methylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]ethyl]azanium Openeye Name: diethyl-[2-[[1-(o-tolyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl]methyleneamino]ethyl]ammonium CAS Name: diethyl-[2-[[1-(2-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]ethyl]ammonium IUPAC Name: diethyl-[2-[[1-(2-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]ethyl]azanium Traditional Name: 2-[[4,6-diketo-1-(o-tolyl)-2-thioxo-hexahydropyrimidin-5-yl]methyleneamino]ethyl-diethyl-ammonium Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN=CC1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2C

Isomeric SMILES

CC[NH+](CC)CCN=CC1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2C

InChI

InChI=1S/C18H24N4O2S/c1-4-21(5-2)11-10-19-12-14-16(23)20-18(25)22(17(14)24)15-9-7-6-8-13(15)3/h6-9,12,14H,4-5,10-11H2,1-3H3,(H,20,23,25)/p+1