6-methyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazole

Systemtic Name: 6-methyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazole Openeye Name: 6-methyl-2-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]-1,3-benzoxazole CAS Name: 6-methyl-2-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-1,3-benzoxazole IUPAC Name: 6-methyl-2-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazole Traditional Name: 6-methyl-2-[(4-tosylpiperazino)methyl]-1,3-benzoxazole Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=C(O3)C=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=C(O3)C=C(C=C4)C

InChI

InChI=1S/C20H23N3O3S/c1-15-3-6-17(7-4-15)27(24,25)23-11-9-22(10-12-23)14-20-21-18-8-5-16(2)13-19(18)26-20/h3-8,13H,9-12,14H2,1-2H3