N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-(4-pyrazin-2-ylpiperazin-1-yl)benzenesulfonamide

Systemtic Name: N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-(4-pyrazin-2-ylpiperazin-1-yl)benzenesulfonamide Openeye Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-4-(4-pyrazin-2-ylpiperazin-1-yl)benzenesulfonamide CAS Name: N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-[4-(2-pyrazinyl)-1-piperazinyl]benzenesulfonamide IUPAC Name: N-[(2R)-1-methoxypropan-2-yl]-3-nitro-4-(4-pyrazin-2-ylpiperazin-1-yl)benzenesulfonamide Traditional Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-3-nitro-4-(4-pyrazin-2-ylpiperazino)benzenesulfonamide Formula: C18H24N6O5S MolecularWeight: 436.48536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](COC)NS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=NC=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H24N6O5S/c1-14(13-29-2)21-30(27,28)15-3-4-16(17(11-15)24(25)26)22-7-9-23(10-8-22)18-12-19-5-6-20-18/h3-6,11-12,14,21H,7-10,13H2,1-2H3/t14-/m1/s1