N-methyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: N-methyl-4-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-N-methyl-3-nitro-benzenesulfonamide Formula: C19H26N6O4S MolecularWeight: 434.51254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C19H26N6O4S/c1-13(2)19-21-14(3)11-18(22-19)24-9-7-23(8-10-24)16-6-5-15(30(28,29)20-4)12-17(16)25(26)27/h5-6,11-13,20H,7-10H2,1-4H3