[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(4-pyridyl)methanone CAS Name: [4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-pyridin-4-ylmethanone IUPAC Name: [4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]-(4-pyridyl)methanone Formula: C17H18N4O5S MolecularWeight: 390.41362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=NC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C17H18N4O5S/c1-13-2-3-15(21(23)24)12-16(13)27(25,26)20-10-8-19(9-11-20)17(22)14-4-6-18-7-5-14/h2-7,12H,8-11H2,1H3