N-[(4-chlorophenyl)methyl]-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxo-butanamide CAS Name: N-[(4-chlorophenyl)methyl]-4-[4-(4,6-dimethyl-2-pyrimidinyl)-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxobutanamide Traditional Name: N-(4-chlorobenzyl)-4-[4-(4,6-dimethylpyrimidin-2-yl)piperazino]-4-keto-butyramide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)CCC(=O)NCC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)CCC(=O)NCC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H26ClN5O2/c1-15-13-16(2)25-21(24-15)27-11-9-26(10-12-27)20(29)8-7-19(28)23-14-17-3-5-18(22)6-4-17/h3-6,13H,7-12,14H2,1-2H3,(H,23,28)