5-[4-(7-chloranylquinolin-4-yl)piperazin-1-yl]sulfonyl-3-methyl-1,3-benzoxazol-2-one

Systemtic Name: 5-[4-(7-chloranylquinolin-4-yl)piperazin-1-yl]sulfonyl-3-methyl-1,3-benzoxazol-2-one Openeye Name: 5-[4-(7-chloro-4-quinolyl)piperazin-1-yl]sulfonyl-3-methyl-1,3-benzoxazol-2-one CAS Name: 5-[[4-(7-chloro-4-quinolinyl)-1-piperazinyl]sulfonyl]-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 5-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]sulfonyl-3-methyl-1,3-benzoxazol-2-one Traditional Name: 5-[4-(7-chloro-4-quinolyl)piperazino]sulfonyl-3-methyl-1,3-benzoxazol-2-one Formula: C21H19ClN4O4S MolecularWeight: 458.91796

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=C5C=CC(=CC5=NC=C4)Cl)OC1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=C5C=CC(=CC5=NC=C4)Cl)OC1=O

InChI

InChI=1S/C21H19ClN4O4S/c1-24-19-13-15(3-5-20(19)30-21(24)27)31(28,29)26-10-8-25(9-11-26)18-6-7-23-17-12-14(22)2-4-16(17)18/h2-7,12-13H,8-11H2,1H3