[1,3-bis(2-methylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylidene-cyclopropyl-azanium

Systemtic Name: [1,3-bis(2-methylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylidene-cyclopropyl-azanium Openeye Name: [1,3-bis(o-tolyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl]methylene-cyclopropyl-ammonium CAS Name: [1,3-bis(2-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylidene-cyclopropylammonium IUPAC Name: [1,3-bis(2-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]methylidene-cyclopropylazanium Traditional Name: cyclopropyl-[[4,6-diketo-1,3-bis(o-tolyl)-2-thioxo-hexahydropyrimidin-5-yl]methylene]ammonium Formula: C22H22N3O2S+ MolecularWeight: 392.49398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(C(=O)N(C2=S)C3=CC=CC=C3C)C=[NH+]C4CC4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(C(=O)N(C2=S)C3=CC=CC=C3C)C=[NH+]C4CC4

InChI

InChI=1S/C22H21N3O2S/c1-14-7-3-5-9-18(14)24-20(26)17(13-23-16-11-12-16)21(27)25(22(24)28)19-10-6-4-8-15(19)2/h3-10,13,16-17H,11-12H2,1-2H3/p+1