N-[3-[[2-(1-adamantyl)ethanoylamino]carbamoyl]phenyl]propane-1-sulfonamide

Systemtic Name: N-[3-[[2-(1-adamantyl)ethanoylamino]carbamoyl]phenyl]propane-1-sulfonamide Openeye Name: N-[3-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]phenyl]propane-1-sulfonamide CAS Name: N-[3-[[[2-(1-adamantyl)-1-oxoethyl]hydrazo]-oxomethyl]phenyl]-1-propanesulfonamide IUPAC Name: N-[3-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]phenyl]propane-1-sulfonamide Traditional Name: N-[3-[[[2-(1-adamantyl)acetyl]amino]carbamoyl]phenyl]propane-1-sulfonamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC=CC(=C1)C(=O)NNC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCS(=O)(=O)NC1=CC=CC(=C1)C(=O)NNC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H31N3O4S/c1-2-6-30(28,29)25-19-5-3-4-18(10-19)21(27)24-23-20(26)14-22-11-15-7-16(12-22)9-17(8-15)13-22/h3-5,10,15-17,25H,2,6-9,11-14H2,1H3,(H,23,26)(H,24,27)