N-[(4-chlorophenyl)methyl]-2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(oxolan-3-ylcarbonyl)piperazin-2-yl]ethanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(oxolan-3-ylcarbonyl)piperazin-2-yl]ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(tetrahydrofuran-3-carbonyl)piperazin-2-yl]acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-4-[oxo(3-oxolanyl)methyl]-2-piperazinyl]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-4-(oxolane-3-carbonyl)piperazin-2-yl]acetamide Traditional Name: N-(4-chlorobenzyl)-2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(tetrahydrofuran-3-carbonyl)piperazin-2-yl]acetamide Formula: C26H30ClN7O3 MolecularWeight: 524.0145

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(CC3CC(=O)NCC4=CC=C(C=C4)Cl)C(=O)C5CCOC5

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(CC3CC(=O)NCC4=CC=C(C=C4)Cl)C(=O)C5CCOC5

InChI

InChI=1S/C26H30ClN7O3/c1-18-12-23(31-26(30-18)33-8-7-28-17-33)34-10-9-32(25(36)20-6-11-37-16-20)15-22(34)13-24(35)29-14-19-2-4-21(27)5-3-19/h2-5,7-8,12,17,20,22H,6,9-11,13-16H2,1H3,(H,29,35)