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

Systemtic Name: 2-[[4,6-bis(oxidanylidene)-1-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]ethyl-diethyl-azanium Openeye Name: 2-[(4,6-dioxo-1-phenyl-2-thioxo-hexahydropyrimidin-5-yl)methyleneamino]ethyl-diethyl-ammonium CAS Name: 2-[(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)methylideneamino]ethyl-diethylammonium IUPAC Name: 2-[(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)methylideneamino]ethyl-diethylazanium Traditional Name: 2-[(4,6-diketo-1-phenyl-2-thioxo-hexahydropyrimidin-5-yl)methyleneamino]ethyl-diethyl-ammonium Formula: C17H23N4O2S+ MolecularWeight: 347.45512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O2S/c1-3-20(4-2)11-10-18-12-14-15(22)19-17(24)21(16(14)23)13-8-6-5-7-9-13/h5-9,12,14H,3-4,10-11H2,1-2H3,(H,19,22,24)/p+1