S-methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenecarbothioate

Systemtic Name: S-methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenecarbothioate Openeye Name: S-methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenecarbothioate CAS Name: 2-[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoyl]benzenecarbothioic acid S-methyl ester IUPAC Name: S-methyl 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenecarbothioate Traditional Name: 2-[(4-methoxy-6-methyl-s-triazin-2-yl)carbamoylsulfamoyl]thiobenzoic acid S-methyl ester Formula: C14H15N5O5S2 MolecularWeight: 397.4294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)SC

Isomeric SMILES

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)SC

InChI

InChI=1S/C14H15N5O5S2/c1-8-15-12(18-14(16-8)24-2)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)25-3/h4-7H,1-3H3,(H2,15,16,17,18,19,21)