N-[4-[[5-(3,4-dimethoxyphenyl)-2-oxidanylidene-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]pentanamide

Systemtic Name: N-[4-[[5-(3,4-dimethoxyphenyl)-2-oxidanylidene-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]pentanamide Openeye Name: N-[4-[[5-(3,4-dimethoxyphenyl)-2-oxo-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]pentanamide CAS Name: N-[4-[[5-(3,4-dimethoxyphenyl)-2-oxo-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]pentanamide IUPAC Name: N-[4-[[5-(3,4-dimethoxyphenyl)-2-oxo-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]pentanamide Traditional Name: N-[4-[[5-(3,4-dimethoxyphenyl)-2-keto-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]valeramide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)CN2C(=O)SCC(=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)CN2C(=O)SCC(=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H27N3O4S/c1-4-5-6-22(27)24-18-10-7-16(8-11-18)14-26-23(28)31-15-19(25-26)17-9-12-20(29-2)21(13-17)30-3/h7-13H,4-6,14-15H2,1-3H3,(H,24,27)