N-butan-2-yl-5-[(2-fluorophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: N-butan-2-yl-5-[(2-fluorophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(2-fluorophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-5-[[(2-fluoroanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: N-butan-2-yl-5-[(2-fluorophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-[(2-fluorophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazino]-N-sec-butyl-benzamide Formula: C29H34FN5O3 MolecularWeight: 519.610363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC=C2F)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC=C2F)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C29H34FN5O3/c1-4-20(2)31-28(36)22-19-21(32-29(37)33-24-10-6-5-9-23(24)30)13-14-25(22)34-15-17-35(18-16-34)26-11-7-8-12-27(26)38-3/h5-14,19-20H,4,15-18H2,1-3H3,(H,31,36)(H2,32,33,37)