3-[4-(diethylamino)phenyl]-4-[(4-propoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[4-(diethylamino)phenyl]-4-[(4-propoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[4-(diethylamino)phenyl]-4-[(4-propoxyphenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-[4-(diethylamino)phenyl]-4-[(4-propoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[4-(diethylamino)phenyl]-4-[(4-propoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-[4-(diethylamino)phenyl]-4-[(4-propoxybenzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)N(CC)CC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)N(CC)CC

InChI

InChI=1S/C22H27N5OS/c1-4-15-28-20-13-7-17(8-14-20)16-23-27-21(24-25-22(27)29)18-9-11-19(12-10-18)26(5-2)6-3/h7-14,16H,4-6,15H2,1-3H3,(H,25,29)