[5-ethyl-1-(6-methoxypyridazin-3-yl)pyrazol-4-yl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: [5-ethyl-1-(6-methoxypyridazin-3-yl)pyrazol-4-yl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone Openeye Name: [5-ethyl-1-(6-methoxypyridazin-3-yl)pyrazol-4-yl]-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]methanone CAS Name: [5-ethyl-1-(6-methoxy-3-pyridazinyl)-4-pyrazolyl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone IUPAC Name: [5-ethyl-1-(6-methoxypyridazin-3-yl)pyrazol-4-yl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone Traditional Name: [5-ethyl-1-(6-methoxypyridazin-3-yl)pyrazol-4-yl]-(4-tosyl-1,4-diazepan-1-yl)methanone Formula: C23H28N6O4S MolecularWeight: 484.57122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=NN=C(C=C2)OC)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C(C=NN1C2=NN=C(C=C2)OC)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H28N6O4S/c1-4-20-19(16-24-29(20)21-10-11-22(33-3)26-25-21)23(30)27-12-5-13-28(15-14-27)34(31,32)18-8-6-17(2)7-9-18/h6-11,16H,4-5,12-15H2,1-3H3