2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)propanamide

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)propanamide Openeye Name: N-(4-ethylphenyl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: 2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-N-(4-ethylphenyl)propanamide IUPAC Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)propanamide Traditional Name: N-(4-ethylphenyl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]propionamide Formula: C25H35N3O3S MolecularWeight: 457.6287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)CC

InChI

InChI=1S/C25H35N3O3S/c1-5-19(3)22-9-13-24(14-10-22)32(30,31)28-17-15-27(16-18-28)20(4)25(29)26-23-11-7-21(6-2)8-12-23/h7-14,19-20H,5-6,15-18H2,1-4H3,(H,26,29)