4-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-(phenylsulfonyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-(phenylsulfonyl)-1,4-diazepane-1-carboxamide Openeye Name: N-(benzenesulfonyl)-4-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]-1,4-diazepane-1-carboxamide CAS Name: N-(benzenesulfonyl)-4-[1-(4,6-dimethyl-2-pyrimidinyl)-4-piperidinyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(benzenesulfonyl)-4-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-besyl-4-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]-1,4-diazepane-1-carboxamide Formula: C23H32N6O3S MolecularWeight: 472.60358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)N3CCCN(CC3)C(=O)NS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)N3CCCN(CC3)C(=O)NS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H32N6O3S/c1-18-17-19(2)25-22(24-18)28-13-9-20(10-14-28)27-11-6-12-29(16-15-27)23(30)26-33(31,32)21-7-4-3-5-8-21/h3-5,7-8,17,20H,6,9-16H2,1-2H3,(H,26,30)