4-(4-methylphenyl)sulfonyl-5-[4-(phenylmethyl)piperazin-1-yl]-2-thiophen-2-yl-1,3-oxazole

Systemtic Name: 4-(4-methylphenyl)sulfonyl-5-[4-(phenylmethyl)piperazin-1-yl]-2-thiophen-2-yl-1,3-oxazole Openeye Name: 5-(4-benzylpiperazin-1-yl)-4-(p-tolylsulfonyl)-2-(2-thienyl)oxazole CAS Name: 4-(4-methylphenyl)sulfonyl-5-[4-(phenylmethyl)-1-piperazinyl]-2-thiophen-2-yloxazole IUPAC Name: 5-(4-benzylpiperazin-1-yl)-4-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazole Traditional Name: 5-(4-benzylpiperazino)-2-(2-thienyl)-4-tosyl-oxazole Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H25N3O3S2/c1-19-9-11-21(12-10-19)33(29,30)24-25(31-23(26-24)22-8-5-17-32-22)28-15-13-27(14-16-28)18-20-6-3-2-4-7-20/h2-12,17H,13-16,18H2,1H3