5-(3,4-dimethoxyphenyl)-6-ethyl-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-6-ethyl-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one Openeye Name: 5-(3,4-dimethoxyphenyl)-6-ethyl-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one CAS Name: 5-(3,4-dimethoxyphenyl)-6-ethyl-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one IUPAC Name: 5-(3,4-dimethoxyphenyl)-6-ethyl-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one Traditional Name: 5-(3,4-dimethoxyphenyl)-6-ethyl-3-(4-nitrobenzyl)-6H-1,3,4-thiadiazin-2-one Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NN(C(=O)S1)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1C(=NN(C(=O)S1)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H21N3O5S/c1-4-18-19(14-7-10-16(27-2)17(11-14)28-3)21-22(20(24)29-18)12-13-5-8-15(9-6-13)23(25)26/h5-11,18H,4,12H2,1-3H3