1-(4-chlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)-2-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]guanidine

Systemtic Name: 1-(4-chlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)-2-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]guanidine Openeye Name: 1-(4-chlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)-2-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methyl]guanidine CAS Name: 1-(4-chlorophenyl)-3-(4,6-dimethyl-2-pyrimidinyl)-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]guanidine IUPAC Name: 1-(4-chlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]guanidine Traditional Name: 1-(4-chlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)-2-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methyl]guanidine Formula: C18H16ClN7O3 MolecularWeight: 413.81774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NC=C2C(=O)NC(=O)NC2=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NC=C2C(=O)NC(=O)NC2=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H16ClN7O3/c1-9-7-10(2)22-17(21-9)26-16(23-12-5-3-11(19)4-6-12)20-8-13-14(27)24-18(29)25-15(13)28/h3-8H,1-2H3,(H2,20,21,22,23,26)(H2,24,25,27,28,29)