N-[5-(1,4-diazepan-1-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]benzenesulfonamide

Systemtic Name: N-[5-(1,4-diazepan-1-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]benzenesulfonamide Openeye Name: N-[5-(1,4-diazepan-1-yl)-2-[[(E)-styryl]sulfonylamino]phenyl]benzenesulfonamide CAS Name: N-[5-(1,4-diazepan-1-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]benzenesulfonamide IUPAC Name: N-[5-(1,4-diazepan-1-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]phenyl]benzenesulfonamide Traditional Name: N-[5-(1,4-diazepan-1-yl)-2-[[(E)-styryl]sulfonylamino]phenyl]benzenesulfonamide Formula: C25H28N4O4S2 MolecularWeight: 512.64422

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)C=CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)/C=C/C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O4S2/c30-34(31,19-14-21-8-3-1-4-9-21)27-24-13-12-22(29-17-7-15-26-16-18-29)20-25(24)28-35(32,33)23-10-5-2-6-11-23/h1-6,8-14,19-20,26-28H,7,15-18H2/b19-14+