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

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propyl-benzamide Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propyl-benzamide CAS Name: 5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-propylbenzamide IUPAC Name: 5-[(3-chloro-4-fluorophenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propylbenzamide Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazino]-N-propyl-benzamide Formula: C28H31ClFN5O3 MolecularWeight: 540.028843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31ClFN5O3/c1-3-12-31-27(36)21-17-19(32-28(37)33-20-8-10-23(30)22(29)18-20)9-11-24(21)34-13-15-35(16-14-34)25-6-4-5-7-26(25)38-2/h4-11,17-18H,3,12-16H2,1-2H3,(H,31,36)(H2,32,33,37)