4-fluoranyl-N-[3-methyl-1-[4-[4-(3-methylphenyl)piperazin-1-yl]butylamino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[3-methyl-1-[4-[4-(3-methylphenyl)piperazin-1-yl]butylamino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-fluoro-N-[2-methyl-1-[4-[4-(m-tolyl)piperazin-1-yl]butylcarbamoyl]propyl]benzamide CAS Name: 4-fluoro-N-[3-methyl-1-[4-[4-(3-methylphenyl)-1-piperazinyl]butylamino]-1-oxobutan-2-yl]benzamide IUPAC Name: 4-fluoro-N-[3-methyl-1-[4-[4-(3-methylphenyl)piperazin-1-yl]butylamino]-1-oxobutan-2-yl]benzamide Traditional Name: 4-fluoro-N-[2-methyl-1-[4-[4-(m-tolyl)piperazino]butylcarbamoyl]propyl]benzamide Formula: C27H37FN4O2 MolecularWeight: 468.606683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C(C(C)C)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C(C(C)C)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C27H37FN4O2/c1-20(2)25(30-26(33)22-9-11-23(28)12-10-22)27(34)29-13-4-5-14-31-15-17-32(18-16-31)24-8-6-7-21(3)19-24/h6-12,19-20,25H,4-5,13-18H2,1-3H3,(H,29,34)(H,30,33)