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

Systemtic Name: 2-[methyl-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]amino]-N-propyl-ethanamide Openeye Name: 2-[N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-anilino]-N-propyl-acetamide CAS Name: 2-[N-methyl-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroanilino]-N-propylacetamide IUPAC Name: 2-[N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroanilino]-N-propylacetamide Traditional Name: 2-[N-methyl-4-(4-methylpiperazino)sulfonyl-2-nitro-anilino]-N-propyl-acetamide Formula: C17H27N5O5S MolecularWeight: 413.49178

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H27N5O5S/c1-4-7-18-17(23)13-20(3)15-6-5-14(12-16(15)22(24)25)28(26,27)21-10-8-19(2)9-11-21/h5-6,12H,4,7-11,13H2,1-3H3,(H,18,23)