3-[[(3-chloranyl-4-methyl-phenyl)amino]methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[(3-chloranyl-4-methyl-phenyl)amino]methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-[(3-chloro-4-methyl-anilino)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3-chloro-4-methylanilino)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-[(3-chloro-4-methylanilino)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-[(3-chloro-4-methyl-anilino)methyl]-1H-1,2,4-triazole-5-thione Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=NNC(=S)N2CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=NNC(=S)N2CC3=CC=CC=C3)Cl

InChI

InChI=1S/C17H17ClN4S/c1-12-7-8-14(9-15(12)18)19-10-16-20-21-17(23)22(16)11-13-5-3-2-4-6-13/h2-9,19H,10-11H2,1H3,(H,21,23)