2-(3-chloranyl-4-pyrrolidin-1-ylsulfonyl-phenyl)-1,2,4-triazine-3,5-dione

Systemtic Name: 2-(3-chloranyl-4-pyrrolidin-1-ylsulfonyl-phenyl)-1,2,4-triazine-3,5-dione Openeye Name: 2-(3-chloro-4-pyrrolidin-1-ylsulfonyl-phenyl)-1,2,4-triazine-3,5-dione CAS Name: 2-[3-chloro-4-(1-pyrrolidinylsulfonyl)phenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-(3-chloro-4-pyrrolidin-1-ylsulfonylphenyl)-1,2,4-triazine-3,5-dione Traditional Name: 2-(3-chloro-4-pyrrolidinosulfonyl-phenyl)-1,2,4-triazine-3,5-quinone Formula: C13H13ClN4O4S MolecularWeight: 356.78472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=C(C=C2)N3C(=O)NC(=O)C=N3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=C(C=C2)N3C(=O)NC(=O)C=N3)Cl

InChI

InChI=1S/C13H13ClN4O4S/c14-10-7-9(18-13(20)16-12(19)8-15-18)3-4-11(10)23(21,22)17-5-1-2-6-17/h3-4,7-8H,1-2,5-6H2,(H,16,19,20)