1-ethyl-1-[(3-fluorophenyl)methyl]-3-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]urea

Systemtic Name: 1-ethyl-1-[(3-fluorophenyl)methyl]-3-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]urea Openeye Name: 1-ethyl-1-[(3-fluorophenyl)methyl]-3-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]urea CAS Name: 1-ethyl-1-[(3-fluorophenyl)methyl]-3-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]urea IUPAC Name: 1-ethyl-1-[(3-fluorophenyl)methyl]-3-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]urea Traditional Name: 1-ethyl-1-(3-fluorobenzyl)-3-[2-methyl-4-(4-methylpiperazino)phenyl]urea Formula: C22H29FN4O MolecularWeight: 384.490263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C

InChI

InChI=1S/C22H29FN4O/c1-4-26(16-18-6-5-7-19(23)15-18)22(28)24-21-9-8-20(14-17(21)2)27-12-10-25(3)11-13-27/h5-9,14-15H,4,10-13,16H2,1-3H3,(H,24,28)