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

Systemtic Name: N,N-diethyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-3-nitro-benzenesulfonamide Formula: C22H32N6O4S MolecularWeight: 476.59228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32N6O4S/c1-6-27(7-2)33(31,32)18-8-9-19(20(15-18)28(29)30)25-10-12-26(13-11-25)21-14-17(5)23-22(24-21)16(3)4/h8-9,14-16H,6-7,10-13H2,1-5H3