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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-[2-(4-nitrophenyl)ethyl]-6H-1,3,4-thiadiazin-2-one Openeye Name: 5-(3,4-dimethoxyphenyl)-3-[2-(4-nitrophenyl)ethyl]-6H-1,3,4-thiadiazin-2-one CAS Name: 5-(3,4-dimethoxyphenyl)-3-[2-(4-nitrophenyl)ethyl]-6H-1,3,4-thiadiazin-2-one IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-[2-(4-nitrophenyl)ethyl]-6H-1,3,4-thiadiazin-2-one Traditional Name: 5-(3,4-dimethoxyphenyl)-3-[2-(4-nitrophenyl)ethyl]-6H-1,3,4-thiadiazin-2-one Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)SC2)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)SC2)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19N3O5S/c1-26-17-8-5-14(11-18(17)27-2)16-12-28-19(23)21(20-16)10-9-13-3-6-15(7-4-13)22(24)25/h3-8,11H,9-10,12H2,1-2H3