phenyl N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamimidate

Systemtic Name: phenyl N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamimidate Openeye Name: 3-(2-chlorophenyl)sulfonyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-2-phenyl-isourea CAS Name: N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamimidic acid phenyl ester IUPAC Name: phenyl N'-(2-chlorophenyl)sulfonyl-N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamimidate Traditional Name: 3-(2-chlorophenyl)sulfonyl-1-(4,6-dimethoxy-s-triazin-2-yl)-2-phenyl-isourea Formula: C18H16ClN5O5S MolecularWeight: 449.86814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NC(=NS(=O)(=O)C2=CC=CC=C2Cl)OC3=CC=CC=C3)OC

Isomeric SMILES

COC1=NC(=NC(=N1)N/C(=N/S(=O)(=O)C2=CC=CC=C2Cl)/OC3=CC=CC=C3)OC

InChI

InChI=1S/C18H16ClN5O5S/c1-27-16-20-15(21-17(23-16)28-2)22-18(29-12-8-4-3-5-9-12)24-30(25,26)14-11-7-6-10-13(14)19/h3-11H,1-2H3,(H,20,21,22,23,24)