3-[(2-chlorophenyl)methylsulfanyl]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-chlorophenyl)methylsulfanyl]-5-isopropyl-1,2,4-triazole CAS Name: 3-[(2-chlorophenyl)methylthio]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-chlorobenzyl)thio]-5-isopropyl-1,2,4-triazole Formula: C15H18ClN3S MolecularWeight: 307.84152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC=C)SCC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)C1=NN=C(N1CC=C)SCC2=CC=CC=C2Cl

InChI

InChI=1S/C15H18ClN3S/c1-4-9-19-14(11(2)3)17-18-15(19)20-10-12-7-5-6-8-13(12)16/h4-8,11H,1,9-10H2,2-3H3