4-(2-methylsulfonylphenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 4-(2-methylsulfonylphenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine Openeye Name: 4-(2-methylsulfonylphenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine CAS Name: 4-(2-methylsulfonylphenyl)sulfonyl-8-(1-piperazinyl)-2,3-dihydro-1,4-benzoxazine IUPAC Name: 4-(2-methylsulfonylphenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-(2-mesylphenyl)sulfonyl-8-piperazino-2,3-dihydro-1,4-benzoxazine Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)N2CCOC3=C(C=CC=C32)N4CCNCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)N2CCOC3=C(C=CC=C32)N4CCNCC4

InChI

InChI=1S/C19H23N3O5S2/c1-28(23,24)17-7-2-3-8-18(17)29(25,26)22-13-14-27-19-15(5-4-6-16(19)22)21-11-9-20-10-12-21/h2-8,20H,9-14H2,1H3