ethyl 1-(butylsulfonylamino)-2-phenyl-2-(4-pyridin-4-ylpiperazin-1-yl)cyclopropane-1-carboxylate

Systemtic Name: ethyl 1-(butylsulfonylamino)-2-phenyl-2-(4-pyridin-4-ylpiperazin-1-yl)cyclopropane-1-carboxylate Openeye Name: ethyl 1-(butylsulfonylamino)-2-phenyl-2-[4-(4-pyridyl)piperazin-1-yl]cyclopropanecarboxylate CAS Name: 1-(butylsulfonylamino)-2-phenyl-2-(4-pyridin-4-yl-1-piperazinyl)-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(butylsulfonylamino)-2-phenyl-2-(4-pyridin-4-ylpiperazin-1-yl)cyclopropane-1-carboxylate Traditional Name: 1-(butylsulfonylamino)-2-phenyl-2-[4-(4-pyridyl)piperazino]cyclopropanecarboxylic acid ethyl ester Formula: C25H34N4O4S MolecularWeight: 486.62686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1(CC1(C2=CC=CC=C2)N3CCN(CC3)C4=CC=NC=C4)C(=O)OCC

Isomeric SMILES

CCCCS(=O)(=O)NC1(CC1(C2=CC=CC=C2)N3CCN(CC3)C4=CC=NC=C4)C(=O)OCC

InChI

InChI=1S/C25H34N4O4S/c1-3-5-19-34(31,32)27-24(23(30)33-4-2)20-25(24,21-9-7-6-8-10-21)29-17-15-28(16-18-29)22-11-13-26-14-12-22/h6-14,27H,3-5,15-20H2,1-2H3