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

Systemtic Name: 3-butyl-4-[(E)-(4-propoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-butyl-4-[(E)-(4-propoxyphenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-butyl-4-[(E)-(4-propoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-butyl-4-[(E)-(4-propoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-butyl-4-[(E)-(4-propoxybenzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NNC(=S)N1N=CC2=CC=C(C=C2)OCCC

Isomeric SMILES

CCCCC1=NNC(=S)N1/N=C/C2=CC=C(C=C2)OCCC

InChI

InChI=1S/C16H22N4OS/c1-3-5-6-15-18-19-16(22)20(15)17-12-13-7-9-14(10-8-13)21-11-4-2/h7-10,12H,3-6,11H2,1-2H3,(H,19,22)/b17-12+