N-[(1R)-1-(furan-2-yl)ethyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[(1R)-1-(furan-2-yl)ethyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[(1R)-1-(2-furyl)ethyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline CAS Name: N-[(1R)-1-(2-furanyl)ethyl]-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[(1R)-1-(furan-2-yl)ethyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [(1R)-1-(2-furyl)ethyl]-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]amine Formula: C17H22N4O5S MolecularWeight: 394.44538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CO1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O5S/c1-13(17-4-3-11-26-17)18-15-6-5-14(12-16(15)21(22)23)27(24,25)20-9-7-19(2)8-10-20/h3-6,11-13,18H,7-10H2,1-2H3/t13-/m1/s1