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

Systemtic Name: 2-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-methyl-1,3-benzoxazole Openeye Name: 2-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-methyl-1,3-benzoxazole CAS Name: 2-[[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-6-methyl-1,3-benzoxazole IUPAC Name: 2-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-methyl-1,3-benzoxazole Traditional Name: 6-methyl-2-[(4-p-phenetylsulfonylpiperazino)methyl]-1,3-benzoxazole Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=C(O3)C=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=C(O3)C=C(C=C4)C

InChI

InChI=1S/C21H25N3O4S/c1-3-27-17-5-7-18(8-6-17)29(25,26)24-12-10-23(11-13-24)15-21-22-19-9-4-16(2)14-20(19)28-21/h4-9,14H,3,10-13,15H2,1-2H3