N-methyl-N-[(5-methylfuran-2-yl)methyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline CAS Name: N-methyl-N-[(5-methyl-2-furanyl)methyl]-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroaniline Traditional Name: methyl-[(5-methyl-2-furyl)methyl]-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]amine Formula: C18H24N4O5S MolecularWeight: 408.47196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)CN(C)C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O5S/c1-14-4-5-15(27-14)13-20(3)17-7-6-16(12-18(17)22(23)24)28(25,26)21-10-8-19(2)9-11-21/h4-7,12H,8-11,13H2,1-3H3