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

Systemtic Name: 3-(2-cyclohexylethyl)-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-cyclohexylethyl)-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-cyclohexylethyl)-4-[(2,5-dimethyl-3-pyrrolylidene)methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-cyclohexylethyl)-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-cyclohexylethyl)-4-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-1H-1,2,4-triazole-5-thione Formula: C17H25N5S MolecularWeight: 331.4789

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNN2C(=NNC2=S)CCC3CCCCC3)C(=N1)C

Isomeric SMILES

CC1=CC(=CNN2C(=NNC2=S)CCC3CCCCC3)C(=N1)C

InChI

InChI=1S/C17H25N5S/c1-12-10-15(13(2)19-12)11-18-22-16(20-21-17(22)23)9-8-14-6-4-3-5-7-14/h10-11,14,18H,3-9H2,1-2H3,(H,21,23)