2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[(E)-N'-ethylsulfonylcarbamimidoyl]ethanamide

Systemtic Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[(E)-N'-ethylsulfonylcarbamimidoyl]ethanamide Openeye Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[(E)-N'-ethylsulfonylcarbamimidoyl]acetamide CAS Name: 2-[2-(1-adamantyl)-5-phenyl-1-pyrrolyl]-N-[(E)-amino(ethylsulfonylimino)methyl]acetamide IUPAC Name: 2-[2-(1-adamantyl)-5-phenylpyrrol-1-yl]-N-[(E)-N'-ethylsulfonylcarbamimidoyl]acetamide Traditional Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]-N-[(E)-N'-esylamidino]acetamide Formula: C25H32N4O3S MolecularWeight: 468.61158

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N=C(N)NC(=O)CN1C(=CC=C1C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

Isomeric SMILES

CCS(=O)(=O)/N=C(\N)/NC(=O)CN1C(=CC=C1C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

InChI

InChI=1S/C25H32N4O3S/c1-2-33(31,32)28-24(26)27-23(30)16-29-21(20-6-4-3-5-7-20)8-9-22(29)25-13-17-10-18(14-25)12-19(11-17)15-25/h3-9,17-19H,2,10-16H2,1H3,(H3,26,27,28,30)