2-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanoylamino]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanoylamino]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]acetyl]amino]-N-(4-fluorophenyl)acetamide CAS Name: 2-[[2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-1-oxoethyl]amino]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]acetyl]amino]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[2-[4-(azepan-1-ylsulfonyl)piperazino]acetyl]amino]-N-(4-fluorophenyl)acetamide Formula: C20H30FN5O4S MolecularWeight: 455.546703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H30FN5O4S/c21-17-5-7-18(8-6-17)23-19(27)15-22-20(28)16-24-11-13-26(14-12-24)31(29,30)25-9-3-1-2-4-10-25/h5-8H,1-4,9-16H2,(H,22,28)(H,23,27)