4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-[(3-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-[(3-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-[(3-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(2,5-dimethyl-3-pyrrolylidene)methylamino]-3-[(3-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-[(3-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-[(3-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C17H19N5O2S MolecularWeight: 357.43006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNN2C(=NNC2=S)COC3=CC=CC(=C3)OC)C(=N1)C

Isomeric SMILES

CC1=CC(=CNN2C(=NNC2=S)COC3=CC=CC(=C3)OC)C(=N1)C

InChI

InChI=1S/C17H19N5O2S/c1-11-7-13(12(2)19-11)9-18-22-16(20-21-17(22)25)10-24-15-6-4-5-14(8-15)23-3/h4-9,18H,10H2,1-3H3,(H,21,25)