3-[4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]-4-oxo-butyl]-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]-4-oxobutyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]-4-oxobutyl]-1,3-benzoxazol-2-one Traditional Name: 3-[4-keto-4-[4-(4-methylpiperazino)sulfonylpiperazino]butyl]-1,3-benzoxazol-2-one Formula: C20H29N5O5S MolecularWeight: 451.53976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H29N5O5S/c1-21-9-13-23(14-10-21)31(28,29)24-15-11-22(12-16-24)19(26)7-4-8-25-17-5-2-3-6-18(17)30-20(25)27/h2-3,5-6H,4,7-16H2,1H3