4-[3-(3,5-dimethylpiperidin-1-yl)propyl]-8-fluoranyl-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[3-(3,5-dimethylpiperidin-1-yl)propyl]-8-fluoranyl-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[3-(3,5-dimethyl-1-piperidyl)propyl]-8-fluoro-6-[(E)-(4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one CAS Name: 4-[3-(3,5-dimethyl-1-piperidinyl)propyl]-8-fluoro-6-[(E)-(4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[3-(3,5-dimethylpiperidin-1-yl)propyl]-8-fluoro-6-[(E)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Traditional Name: 4-[3-(3,5-dimethylpiperidino)propyl]-8-fluoro-6-[(E)-(4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Formula: C22H26FN3O3S2 MolecularWeight: 463.588543

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCCN2C(=O)COC3=C2C=C(C=C3F)C=C4C(=O)NC(=S)S4)C

Isomeric SMILES

CC1CC(CN(C1)CCCN2C(=O)COC3=C2C=C(C=C3F)/C=C/4\C(=O)NC(=S)S4)C

InChI

InChI=1S/C22H26FN3O3S2/c1-13-6-14(2)11-25(10-13)4-3-5-26-17-8-15(9-18-21(28)24-22(30)31-18)7-16(23)20(17)29-12-19(26)27/h7-9,13-14H,3-6,10-12H2,1-2H3,(H,24,28,30)/b18-9+