5-(azepan-1-yl)-4-(4-methylphenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazole

Systemtic Name: 5-(azepan-1-yl)-4-(4-methylphenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazole Openeye Name: 5-(azepan-1-yl)-4-(p-tolylsulfonyl)-2-(3,4,5-trimethoxyphenyl)oxazole CAS Name: 5-(1-azepanyl)-4-(4-methylphenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)oxazole IUPAC Name: 5-(azepan-1-yl)-4-(4-methylphenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazole Traditional Name: 5-(azepan-1-yl)-4-tosyl-2-(3,4,5-trimethoxyphenyl)oxazole Formula: C25H30N2O6S MolecularWeight: 486.5805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC(=C(C(=C3)OC)OC)OC)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC(=C(C(=C3)OC)OC)OC)N4CCCCCC4

InChI

InChI=1S/C25H30N2O6S/c1-17-9-11-19(12-10-17)34(28,29)24-25(27-13-7-5-6-8-14-27)33-23(26-24)18-15-20(30-2)22(32-4)21(16-18)31-3/h9-12,15-16H,5-8,13-14H2,1-4H3