2-[4-[(E)-[1-(2,3-dimethylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]ethanamide

Systemtic Name: 2-[4-[(E)-[1-(2,3-dimethylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]ethanamide Openeye Name: 2-[4-[(E)-[1-(2,3-dimethylphenyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]acetamide CAS Name: 2-[4-[(E)-[1-(2,3-dimethylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide IUPAC Name: 2-[4-[(E)-[1-(2,3-dimethylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide Traditional Name: 2-[4-[(E)-[1-(2,3-dimethylphenyl)-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]acetamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCC(=O)N)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)OCC(=O)N)/C(=O)NC2=S)C

InChI

InChI=1S/C21H19N3O4S/c1-12-4-3-5-17(13(12)2)24-20(27)16(19(26)23-21(24)29)10-14-6-8-15(9-7-14)28-11-18(22)25/h3-10H,11H2,1-2H3,(H2,22,25)(H,23,26,29)/b16-10+