N-(2-dimethylaminoethyl)-2-[(4-fluorophenyl)carbamoylamino]-3-methyl-N-(phenylmethyl)butanamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-[(4-fluorophenyl)carbamoylamino]-3-methyl-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-N-(2-dimethylaminoethyl)-2-[(4-fluorophenyl)carbamoylamino]-3-methyl-butanamide CAS Name: N-(2-dimethylaminoethyl)-2-[[(4-fluoroanilino)-oxomethyl]amino]-3-methyl-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-N-(2-dimethylaminoethyl)-2-[(4-fluorophenyl)carbamoylamino]-3-methylbutanamide Traditional Name: N-benzyl-N-(2-dimethylaminoethyl)-2-[(4-fluorophenyl)carbamoylamino]-3-methyl-butyramide Formula: C23H31FN4O2 MolecularWeight: 414.516243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(CCN(C)C)CC1=CC=CC=C1)NC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)C(C(=O)N(CCN(C)C)CC1=CC=CC=C1)NC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C23H31FN4O2/c1-17(2)21(26-23(30)25-20-12-10-19(24)11-13-20)22(29)28(15-14-27(3)4)16-18-8-6-5-7-9-18/h5-13,17,21H,14-16H2,1-4H3,(H2,25,26,30)