4-[(E)-(4-butoxy-3-methoxy-phenyl)methylideneamino]-3-propyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(4-butoxy-3-methoxy-phenyl)methylideneamino]-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(4-butoxy-3-methoxy-phenyl)methyleneamino]-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(4-butoxy-3-methoxyphenyl)methylideneamino]-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(4-butoxy-3-methoxyphenyl)methylideneamino]-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(4-butoxy-3-methoxy-benzylidene)amino]-3-propyl-1H-1,2,4-triazole-5-thione Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NN2C(=NNC2=S)CCC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N/N2C(=NNC2=S)CCC)OC

InChI

InChI=1S/C17H24N4O2S/c1-4-6-10-23-14-9-8-13(11-15(14)22-3)12-18-21-16(7-5-2)19-20-17(21)24/h8-9,11-12H,4-7,10H2,1-3H3,(H,20,24)/b18-12+