2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-butanamide

Systemtic Name: 2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-butanamide Openeye Name: 2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]-4-methylsulfonyl-butanamide CAS Name: 2-[[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]-N-[(4-methoxyphenyl)methyl]-4-methylsulfonylbutanamide IUPAC Name: 2-[(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]-4-methylsulfonylbutanamide Traditional Name: 2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-4-mesyl-N-p-anisyl-butyramide Formula: C21H26N6O4S MolecularWeight: 458.53394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)NC(CCS(=O)(=O)C)C(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)NC(CCS(=O)(=O)C)C(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N6O4S/c1-15-12-19(26-21(24-15)27-10-9-22-14-27)25-18(8-11-32(3,29)30)20(28)23-13-16-4-6-17(31-2)7-5-16/h4-7,9-10,12,14,18H,8,11,13H2,1-3H3,(H,23,28)(H,24,25,26)