[(2R)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [(2R)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [(2R)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [(2R)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [(2R)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [(2R)-4-esyl-2,3-dihydro-1,4-benzoxazin-2-yl]-(4-phenylpiperazino)methanone Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)N1C[C@@H](OC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O4S/c1-2-29(26,27)24-16-20(28-19-11-7-6-10-18(19)24)21(25)23-14-12-22(13-15-23)17-8-4-3-5-9-17/h3-11,20H,2,12-16H2,1H3/t20-/m1/s1