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

Systemtic Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(2,5-dimethyl-3-pyrrolylidene)methylamino]-3-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-p-phenetyl-1H-1,2,4-triazole-5-thione Formula: C17H19N5OS MolecularWeight: 341.43066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2NC=C3C=C(N=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2NC=C3C=C(N=C3C)C

InChI

InChI=1S/C17H19N5OS/c1-4-23-15-7-5-13(6-8-15)16-20-21-17(24)22(16)18-10-14-9-11(2)19-12(14)3/h5-10,18H,4H2,1-3H3,(H,21,24)