[3-[(8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]phenyl]methanesulfonamide

Systemtic Name: [3-[(8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]phenyl]methanesulfonamide Openeye Name: [3-[(8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]phenyl]methanesulfonamide CAS Name: [3-[[8-(1-piperazinyl)-2,3-dihydro-1,4-benzoxazin-4-yl]sulfonyl]phenyl]methanesulfonamide IUPAC Name: [3-[(8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]phenyl]methanesulfonamide Traditional Name: [3-[(8-piperazino-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]phenyl]methanesulfonamide Formula: C19H24N4O5S2 MolecularWeight: 452.54766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C3C(=CC=C2)N(CCO3)S(=O)(=O)C4=CC=CC(=C4)CS(=O)(=O)N

Isomeric SMILES

C1CN(CCN1)C2=C3C(=CC=C2)N(CCO3)S(=O)(=O)C4=CC=CC(=C4)CS(=O)(=O)N

InChI

InChI=1S/C19H24N4O5S2/c20-29(24,25)14-15-3-1-4-16(13-15)30(26,27)23-11-12-28-19-17(5-2-6-18(19)23)22-9-7-21-8-10-22/h1-6,13,21H,7-12,14H2,(H2,20,24,25)