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

Systemtic Name: N-(2-butan-2-ylphenyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(2-sec-butylphenyl)propanamide CAS Name: N-(2-butan-2-ylphenyl)-2-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(2-butan-2-ylphenyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: 2-[4-(4-fluorophenyl)sulfonylpiperazino]-N-(2-sec-butylphenyl)propionamide Formula: C23H30FN3O3S MolecularWeight: 447.566003

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H30FN3O3S/c1-4-17(2)21-7-5-6-8-22(21)25-23(28)18(3)26-13-15-27(16-14-26)31(29,30)20-11-9-19(24)10-12-20/h5-12,17-18H,4,13-16H2,1-3H3,(H,25,28)