2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole

Systemtic Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole CAS Name: 2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-1,3-benzoxazole IUPAC Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazino]-1,3-benzoxazole Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H25N3O3S/c1-21(2,3)16-8-10-17(11-9-16)28(25,26)24-14-12-23(13-15-24)20-22-18-6-4-5-7-19(18)27-20/h4-11H,12-15H2,1-3H3