3-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione Openeye Name: 3-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[[methyl(veratryl)amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)CN2C(=S)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)CN2C(=S)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5S/c1-21(11-13-7-8-16(26-2)17(9-13)27-3)12-22-19(29)28-18(20-22)14-5-4-6-15(10-14)23(24)25/h4-10H,11-12H2,1-3H3