2-[[1-(4-methoxyphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]ethyl-trimethyl-azanium

Systemtic Name: 2-[[1-(4-methoxyphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]ethyl-trimethyl-azanium Openeye Name: 2-[[1-(4-methoxyphenyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene]methylamino]ethyl-trimethyl-ammonium CAS Name: 2-[[1-(4-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]ethyl-trimethylammonium IUPAC Name: 2-[[1-(4-methoxyphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]ethyl-trimethylazanium Traditional Name: 2-[[4,6-diketo-1-(4-methoxyphenyl)-2-thioxo-hexahydropyrimidin-5-ylidene]methylamino]ethyl-trimethyl-ammonium Formula: C17H23N4O3S+ MolecularWeight: 363.45452

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCNC=C1C(=O)NC(=S)N(C1=O)C2=CC=C(C=C2)OC

Isomeric SMILES

C[N+](C)(C)CCNC=C1C(=O)NC(=S)N(C1=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H22N4O3S/c1-21(2,3)10-9-18-11-14-15(22)19-17(25)20(16(14)23)12-5-7-13(24-4)8-6-12/h5-8,11H,9-10H2,1-4H3,(H-,18,19,22,23,25)/p+1