4-methyl-5-[4-(3-nitropyridin-2-yl)piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one

Systemtic Name: 4-methyl-5-[4-(3-nitropyridin-2-yl)piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one Openeye Name: 4-methyl-5-[4-(3-nitro-2-pyridyl)piperazin-1-yl]sulfonyl-3H-thiazol-2-one CAS Name: 4-methyl-5-[[4-(3-nitro-2-pyridinyl)-1-piperazinyl]sulfonyl]-3H-thiazol-2-one IUPAC Name: 4-methyl-5-[4-(3-nitropyridin-2-yl)piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one Traditional Name: 4-methyl-5-[4-(3-nitro-2-pyridyl)piperazino]sulfonyl-4-thiazolin-2-one Formula: C13H15N5O5S2 MolecularWeight: 385.4187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O5S2/c1-9-12(24-13(19)15-9)25(22,23)17-7-5-16(6-8-17)11-10(18(20)21)3-2-4-14-11/h2-4H,5-8H2,1H3,(H,15,19)