1-(4-methylphenyl)sulfonyl-5-nitro-3-piperazin-1-yl-indazole

Systemtic Name: 1-(4-methylphenyl)sulfonyl-5-nitro-3-piperazin-1-yl-indazole Openeye Name: 5-nitro-3-piperazin-1-yl-1-(p-tolylsulfonyl)indazole CAS Name: 1-(4-methylphenyl)sulfonyl-5-nitro-3-(1-piperazinyl)indazole IUPAC Name: 1-(4-methylphenyl)sulfonyl-5-nitro-3-piperazin-1-ylindazole Traditional Name: 5-nitro-3-piperazino-1-tosyl-indazole Formula: C18H19N5O4S MolecularWeight: 401.43956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)N4CCNCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)N4CCNCC4

InChI

InChI=1S/C18H19N5O4S/c1-13-2-5-15(6-3-13)28(26,27)22-17-7-4-14(23(24)25)12-16(17)18(20-22)21-10-8-19-9-11-21/h2-7,12,19H,8-11H2,1H3