4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethylamino)-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethylamino)-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethylamino)-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethylamino)-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethylamino)-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethylamino)-N-isopropyl-3-nitro-benzenesulfonamide Formula: C15H20N6O4S MolecularWeight: 380.4221

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=NN=C3N2CCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC2=NN=C3N2CCC3)[N+](=O)[O-]

InChI

InChI=1S/C15H20N6O4S/c1-10(2)19-26(24,25)11-5-6-12(13(8-11)21(22)23)16-9-15-18-17-14-4-3-7-20(14)15/h5-6,8,10,16,19H,3-4,7,9H2,1-2H3