phenyl 5-azanyl-3-chloranylsulfonyl-1,2,4-triazole-1-carboxylate

Systemtic Name: phenyl 5-azanyl-3-chloranylsulfonyl-1,2,4-triazole-1-carboxylate Openeye Name: phenyl 5-amino-3-chlorosulfonyl-1,2,4-triazole-1-carboxylate CAS Name: 5-amino-3-chlorosulfonyl-1,2,4-triazole-1-carboxylic acid phenyl ester IUPAC Name: phenyl 5-amino-3-chlorosulfonyl-1,2,4-triazole-1-carboxylate Traditional Name: 5-amino-3-chlorosulfonyl-1,2,4-triazole-1-carboxylic acid phenyl ester Formula: C9H7ClN4O4S MolecularWeight: 302.69428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)N2C(=NC(=N2)S(=O)(=O)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)N2C(=NC(=N2)S(=O)(=O)Cl)N

InChI

InChI=1S/C9H7ClN4O4S/c10-19(16,17)8-12-7(11)14(13-8)9(15)18-6-4-2-1-3-5-6/h1-5H,(H2,11,12,13)