N-[(Z)-[[(2R,3R)-1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]-phenyl-methylidene]amino]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(Z)-[[(2R,3R)-1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]-phenyl-methylidene]amino]-4-methyl-benzenesulfonamide Openeye Name: N-[(Z)-[[(2R,3R)-1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]-phenyl-methylene]amino]-4-methyl-benzenesulfonamide CAS Name: N-[(Z)-[[(2R,3R)-1-cyclohexyl-3-(4-nitrophenyl)-2-aziridinyl]-phenylmethylidene]amino]-4-methylbenzenesulfonamide IUPAC Name: N-[(Z)-[[(2R,3R)-1-cyclohexyl-3-(4-nitrophenyl)aziridin-2-yl]-phenylmethylidene]amino]-4-methylbenzenesulfonamide Traditional Name: N-[(Z)-[[(2R,3R)-1-cyclohexyl-3-(4-nitrophenyl)ethylenimin-2-yl]-phenyl-methylene]amino]-4-methyl-benzenesulfonamide Formula: C28H30N4O4S MolecularWeight: 518.6272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=C(C2C(N2C3CCCCC3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N/N=C(\[C@H]2[C@H](N2C3CCCCC3)C4=CC=C(C=C4)[N+](=O)[O-])/C5=CC=CC=C5

InChI

InChI=1S/C28H30N4O4S/c1-20-12-18-25(19-13-20)37(35,36)30-29-26(21-8-4-2-5-9-21)28-27(31(28)23-10-6-3-7-11-23)22-14-16-24(17-15-22)32(33)34/h2,4-5,8-9,12-19,23,27-28,30H,3,6-7,10-11H2,1H3/b29-26-/t27-,28+,31?/m1/s1