(6-chloranyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (6-chloranyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (6-chloro-4-mesyl-2,3-dihydro-1,4-benzoxazin-2-yl)-(4-phenylpiperazino)methanone Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(OC2=C1C=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CC(OC2=C1C=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H22ClN3O4S/c1-29(26,27)24-14-19(28-18-8-7-15(21)13-17(18)24)20(25)23-11-9-22(10-12-23)16-5-3-2-4-6-16/h2-8,13,19H,9-12,14H2,1H3