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

Systemtic Name: 3-[[ethyl-(phenylmethyl)amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione Openeye Name: 3-[[benzyl(ethyl)amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-[[ethyl-(phenylmethyl)amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[[benzyl(ethyl)amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[[benzyl(ethyl)amino]methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O3S/c1-2-20(12-14-7-4-3-5-8-14)13-21-18(26)25-17(19-21)15-9-6-10-16(11-15)22(23)24/h3-11H,2,12-13H2,1H3