(E)-N-[4-[[2-(1-adamantyl)ethanoylamino]carbamoyl]phenyl]-2-phenyl-ethenesulfonamide

Systemtic Name: (E)-N-[4-[[2-(1-adamantyl)ethanoylamino]carbamoyl]phenyl]-2-phenyl-ethenesulfonamide Openeye Name: (E)-N-[4-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]phenyl]-2-phenyl-ethenesulfonamide CAS Name: (E)-N-[4-[[[2-(1-adamantyl)-1-oxoethyl]hydrazo]-oxomethyl]phenyl]-2-phenylethenesulfonamide IUPAC Name: (E)-N-[4-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]phenyl]-2-phenylethenesulfonamide Traditional Name: (E)-N-[4-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]phenyl]-2-phenyl-ethenesulfonamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NNC(=O)C4=CC=C(C=C4)NS(=O)(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NNC(=O)C4=CC=C(C=C4)NS(=O)(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C27H31N3O4S/c31-25(18-27-15-20-12-21(16-27)14-22(13-20)17-27)28-29-26(32)23-6-8-24(9-7-23)30-35(33,34)11-10-19-4-2-1-3-5-19/h1-11,20-22,30H,12-18H2,(H,28,31)(H,29,32)/b11-10+