6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one CAS Name: 6-[[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]sulfonyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-[4-(4-isopropylbenzyl)piperazino]sulfonyl-4H-1,4-benzoxazin-3-one Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C22H27N3O4S/c1-16(2)18-5-3-17(4-6-18)14-24-9-11-25(12-10-24)30(27,28)19-7-8-21-20(13-19)23-22(26)15-29-21/h3-8,13,16H,9-12,14-15H2,1-2H3,(H,23,26)