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

Systemtic Name: 3-[[(3-chloranyl-2-methyl-phenyl)amino]methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[(3-chloro-2-methyl-anilino)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3-chloro-2-methylanilino)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3-chloro-2-methylanilino)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-[(3-chloro-2-methyl-anilino)methyl]-1H-1,2,4-triazole-5-thione Formula: C13H15ClN4S MolecularWeight: 294.803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NCC2=NNC(=S)N2CC=C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NCC2=NNC(=S)N2CC=C

InChI

InChI=1S/C13H15ClN4S/c1-3-7-18-12(16-17-13(18)19)8-15-11-6-4-5-10(14)9(11)2/h3-6,15H,1,7-8H2,2H3,(H,17,19)