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

Systemtic Name: 6-ethyl-5-(4-methoxy-3-oxidanyl-phenyl)-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one Openeye Name: 6-ethyl-5-(3-hydroxy-4-methoxy-phenyl)-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one CAS Name: 6-ethyl-5-(3-hydroxy-4-methoxyphenyl)-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one IUPAC Name: 6-ethyl-5-(3-hydroxy-4-methoxyphenyl)-3-[(4-nitrophenyl)methyl]-6H-1,3,4-thiadiazin-2-one Traditional Name: 6-ethyl-5-(3-hydroxy-4-methoxy-phenyl)-3-(4-nitrobenzyl)-6H-1,3,4-thiadiazin-2-one Formula: C19H19N3O5S MolecularWeight: 401.43626

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O5S/c1-3-17-18(13-6-9-16(27-2)15(23)10-13)20-21(19(24)28-17)11-12-4-7-14(8-5-12)22(25)26/h4-10,17,23H,3,11H2,1-2H3