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

Systemtic Name: 6-chloranyl-4-(3-methylsulfonylphenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine Openeye Name: 6-chloro-4-(3-methylsulfonylphenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine CAS Name: 6-chloro-4-(3-methylsulfonylphenyl)sulfonyl-8-(1-piperazinyl)-2,3-dihydro-1,4-benzoxazine IUPAC Name: 6-chloro-4-(3-methylsulfonylphenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine Traditional Name: 6-chloro-4-(3-mesylphenyl)sulfonyl-8-piperazino-2,3-dihydro-1,4-benzoxazine Formula: C19H22ClN3O5S2 MolecularWeight: 471.97808

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCOC3=C2C=C(C=C3N4CCNCC4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCOC3=C2C=C(C=C3N4CCNCC4)Cl

InChI

InChI=1S/C19H22ClN3O5S2/c1-29(24,25)15-3-2-4-16(13-15)30(26,27)23-9-10-28-19-17(11-14(20)12-18(19)23)22-7-5-21-6-8-22/h2-4,11-13,21H,5-10H2,1H3