2-methyl-N-[4-[[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]amino]phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-[[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]amino]phenyl]propanamide Openeye Name: 2-methyl-N-[4-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-anilino]phenyl]propanamide CAS Name: 2-methyl-N-[4-[4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroanilino]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroanilino]phenyl]propanamide Traditional Name: 2-methyl-N-[4-[4-(4-methylpiperazino)sulfonyl-2-nitro-anilino]phenyl]propionamide Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H27N5O5S/c1-15(2)21(27)23-17-6-4-16(5-7-17)22-19-9-8-18(14-20(19)26(28)29)32(30,31)25-12-10-24(3)11-13-25/h4-9,14-15,22H,10-13H2,1-3H3,(H,23,27)