2-(diethylaminomethyl)-4-phenyl-5-phenylazanyl-1,2,4-triazole-3-thione

Systemtic Name: 2-(diethylaminomethyl)-4-phenyl-5-phenylazanyl-1,2,4-triazole-3-thione Openeye Name: 5-anilino-2-(diethylaminomethyl)-4-phenyl-1,2,4-triazole-3-thione CAS Name: 5-anilino-2-(diethylaminomethyl)-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 5-anilino-2-(diethylaminomethyl)-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-anilino-2-(diethylaminomethyl)-4-phenyl-1,2,4-triazole-3-thione Formula: C19H23N5S MolecularWeight: 353.48442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CN1C(=S)N(C(=N1)NC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CN1C(=S)N(C(=N1)NC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N5S/c1-3-22(4-2)15-23-19(25)24(17-13-9-6-10-14-17)18(21-23)20-16-11-7-5-8-12-16/h5-14H,3-4,15H2,1-2H3,(H,20,21)