N-[(E)-[(1S)-1-(benzotriazol-1-yl)-1-phenoxy-hexan-2-ylidene]amino]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(E)-[(1S)-1-(benzotriazol-1-yl)-1-phenoxy-hexan-2-ylidene]amino]-4-methyl-benzenesulfonamide Openeye Name: N-[(E)-1-[(S)-benzotriazol-1-yl(phenoxy)methyl]pentylideneamino]-4-methyl-benzenesulfonamide CAS Name: N-[(E)-[(1S)-1-(1-benzotriazolyl)-1-phenoxyhexan-2-ylidene]amino]-4-methylbenzenesulfonamide IUPAC Name: N-[(E)-[(1S)-1-(benzotriazol-1-yl)-1-phenoxyhexan-2-ylidene]amino]-4-methylbenzenesulfonamide Traditional Name: N-[(E)-1-[(S)-benzotriazol-1-yl(phenoxy)methyl]pentylideneamino]-4-methyl-benzenesulfonamide Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NNS(=O)(=O)C1=CC=C(C=C1)C)C(N2C3=CC=CC=C3N=N2)OC4=CC=CC=C4

Isomeric SMILES

CCCC/C(=N\NS(=O)(=O)C1=CC=C(C=C1)C)/[C@@H](N2C3=CC=CC=C3N=N2)OC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3S/c1-3-4-12-23(27-29-34(31,32)21-17-15-19(2)16-18-21)25(33-20-10-6-5-7-11-20)30-24-14-9-8-13-22(24)26-28-30/h5-11,13-18,25,29H,3-4,12H2,1-2H3/b27-23+/t25-/m0/s1