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

Systemtic Name: 2-[[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[allyl-[(5-chloro-2-thienyl)methyl]amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione CAS Name: 2-[[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[allyl-[(5-chloro-2-thienyl)methyl]amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Formula: C17H17ClN4S2 MolecularWeight: 376.92668

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)CN2C(=S)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)CN2C(=S)N=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17ClN4S2/c1-2-10-21(11-14-8-9-15(18)24-14)12-22-17(23)19-16(20-22)13-6-4-3-5-7-13/h2-9H,1,10-12H2,(H,19,20,23)