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

Systemtic Name: 3-tert-butyl-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-tert-butyl-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-tert-butyl-4-[(2,5-dimethyl-3-pyrrolylidene)methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-tert-butyl-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-tert-butyl-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione Formula: C13H19N5S MolecularWeight: 277.38846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNN2C(=NNC2=S)C(C)(C)C)C(=N1)C

Isomeric SMILES

CC1=CC(=CNN2C(=NNC2=S)C(C)(C)C)C(=N1)C

InChI

InChI=1S/C13H19N5S/c1-8-6-10(9(2)15-8)7-14-18-11(13(3,4)5)16-17-12(18)19/h6-7,14H,1-5H3,(H,17,19)