N-methyl-4-[[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-4-[[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-methyl-4-[[(R)-(1-methyl-2-imidazolyl)-phenylmethyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[[(R)-(1-methylimidazol-2-yl)-phenylmethyl]amino]-3-nitrobenzenesulfonamide Traditional Name: N-methyl-4-[[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]amino]-3-nitro-benzenesulfonamide Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NC(C2=CC=CC=C2)C3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N[C@H](C2=CC=CC=C2)C3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4S/c1-19-28(26,27)14-8-9-15(16(12-14)23(24)25)21-17(13-6-4-3-5-7-13)18-20-10-11-22(18)2/h3-12,17,19,21H,1-2H3/t17-/m1/s1