N-butan-2-yl-5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: N-butan-2-yl-5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: N-butan-2-yl-5-[(3-chloro-4-fluorophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazino]-N-sec-butyl-benzamide Formula: C29H33ClFN5O3 MolecularWeight: 554.055423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C29H33ClFN5O3/c1-4-19(2)32-28(37)22-17-20(33-29(38)34-21-9-11-24(31)23(30)18-21)10-12-25(22)35-13-15-36(16-14-35)26-7-5-6-8-27(26)39-3/h5-12,17-19H,4,13-16H2,1-3H3,(H,32,37)(H2,33,34,38)