N-(2,3-dimethylphenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]-3-methyl-butanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]-3-methyl-butanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]-3-methyl-butanamide CAS Name: N-(2,3-dimethylphenyl)-2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-3-methylbutanamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]-3-methylbutanamide Traditional Name: N-(2,3-dimethylphenyl)-2-[(4-fluorobenzyl)carbamoylamino]-3-methyl-butyramide Formula: C21H26FN3O2 MolecularWeight: 371.448443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C(C(C)C)NC(=O)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C(C(C)C)NC(=O)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C21H26FN3O2/c1-13(2)19(20(26)24-18-7-5-6-14(3)15(18)4)25-21(27)23-12-16-8-10-17(22)11-9-16/h5-11,13,19H,12H2,1-4H3,(H,24,26)(H2,23,25,27)