4-[(E)-(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylideneamino]-3-(naphthalen-1-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylideneamino]-3-(naphthalen-1-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(3-bromo-5-methoxy-4-propoxy-phenyl)methyleneamino]-3-(1-naphthylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(3-bromo-5-methoxy-4-propoxyphenyl)methylideneamino]-3-(1-naphthalenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(3-bromo-5-methoxy-4-propoxyphenyl)methylideneamino]-3-(naphthalen-1-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(3-bromo-5-methoxy-4-propoxy-benzylidene)amino]-3-(1-naphthylmethyl)-1H-1,2,4-triazole-5-thione Formula: C24H23BrN4O2S MolecularWeight: 511.43402

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=NN2C(=NNC2=S)CC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=N/N2C(=NNC2=S)CC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C24H23BrN4O2S/c1-3-11-31-23-20(25)12-16(13-21(23)30-2)15-26-29-22(27-28-24(29)32)14-18-9-6-8-17-7-4-5-10-19(17)18/h4-10,12-13,15H,3,11,14H2,1-2H3,(H,28,32)/b26-15+