2-[[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]amino]-N-(3-fluorophenyl)propanamide

Systemtic Name: 2-[[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]amino]-N-(3-fluorophenyl)propanamide Openeye Name: 2-[4-(4-ethylpiperazin-1-yl)-2-methyl-anilino]-N-(3-fluorophenyl)propanamide CAS Name: 2-[4-(4-ethyl-1-piperazinyl)-2-methylanilino]-N-(3-fluorophenyl)propanamide IUPAC Name: 2-[4-(4-ethylpiperazin-1-yl)-2-methylanilino]-N-(3-fluorophenyl)propanamide Traditional Name: 2-[4-(4-ethylpiperazino)-2-methyl-anilino]-N-(3-fluorophenyl)propionamide Formula: C22H29FN4O MolecularWeight: 384.490263

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(C)C(=O)NC3=CC(=CC=C3)F)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(C)C(=O)NC3=CC(=CC=C3)F)C

InChI

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