N-tert-butyl-3-nitro-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-(4-thiazol-2-ylpiperazin-1-yl)benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-[4-(2-thiazolyl)-1-piperazinyl]benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzenesulfonamide Traditional Name: N-tert-butyl-3-nitro-4-(4-thiazol-2-ylpiperazino)benzenesulfonamide Formula: C17H23N5O4S2 MolecularWeight: 425.52562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=NC=CS3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=NC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O4S2/c1-17(2,3)19-28(25,26)13-4-5-14(15(12-13)22(23)24)20-7-9-21(10-8-20)16-18-6-11-27-16/h4-6,11-12,19H,7-10H2,1-3H3