1-[[1,1-bis(oxidanylidene)thiolan-3-yl]-[(4-dimethylaminophenyl)methyl]amino]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[[1,1-bis(oxidanylidene)thiolan-3-yl]-[(4-dimethylaminophenyl)methyl]amino]-3-phenoxy-propan-2-ol Openeye Name: 1-[(4-dimethylaminophenyl)methyl-(1,1-dioxothiolan-3-yl)amino]-3-phenoxy-propan-2-ol CAS Name: 1-[(4-dimethylaminophenyl)methyl-(1,1-dioxo-3-thiolanyl)amino]-3-phenoxy-2-propanol IUPAC Name: 1-[(4-dimethylaminophenyl)methyl-(1,1-dioxothiolan-3-yl)amino]-3-phenoxypropan-2-ol Traditional Name: 1-[(1,1-diketothiolan-3-yl)-[4-(dimethylamino)benzyl]amino]-3-phenoxy-propan-2-ol Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(CC(COC2=CC=CC=C2)O)C3CCS(=O)(=O)C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(CC(COC2=CC=CC=C2)O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C22H30N2O4S/c1-23(2)19-10-8-18(9-11-19)14-24(20-12-13-29(26,27)17-20)15-21(25)16-28-22-6-4-3-5-7-22/h3-11,20-21,25H,12-17H2,1-2H3