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

Systemtic Name: 3-nitro-N-propan-2-yl-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzenesulfonamide Openeye Name: N-isopropyl-3-nitro-4-(4-thiazol-2-ylpiperazin-1-yl)benzenesulfonamide CAS Name: 3-nitro-N-propan-2-yl-4-[4-(2-thiazolyl)-1-piperazinyl]benzenesulfonamide IUPAC Name: 3-nitro-N-propan-2-yl-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzenesulfonamide Traditional Name: N-isopropyl-3-nitro-4-(4-thiazol-2-ylpiperazino)benzenesulfonamide Formula: C16H21N5O4S2 MolecularWeight: 411.49904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O4S2/c1-12(2)18-27(24,25)13-3-4-14(15(11-13)21(22)23)19-6-8-20(9-7-19)16-17-5-10-26-16/h3-5,10-12,18H,6-9H2,1-2H3