N,N-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-sulfonamide

Systemtic Name: N,N-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-sulfonamide Openeye Name: N,N-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-sulfonamide CAS Name: N,N-dimethyl-5-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]-1H-pyrrole-3-sulfonamide IUPAC Name: N,N-dimethyl-5-[(3-methylbutanoylamino)carbamoyl]-1H-pyrrole-3-sulfonamide Traditional Name: 5-[(isovalerylamino)carbamoyl]-N,N-dimethyl-1H-pyrrole-3-sulfonamide Formula: C12H20N4O4S MolecularWeight: 316.3766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=O)C1=CC(=CN1)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C)CC(=O)NNC(=O)C1=CC(=CN1)S(=O)(=O)N(C)C

InChI

InChI=1S/C12H20N4O4S/c1-8(2)5-11(17)14-15-12(18)10-6-9(7-13-10)21(19,20)16(3)4/h6-8,13H,5H2,1-4H3,(H,14,17)(H,15,18)