4-butyl-2-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3-thione

Systemtic Name: 4-butyl-2-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3-thione Openeye Name: 4-butyl-2-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3-thione CAS Name: 4-butyl-2-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3-thione IUPAC Name: 4-butyl-2-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3-thione Traditional Name: 4-butyl-2-p-anisyl-1,2,4-triazolidine-3-thione Formula: C14H21N3OS MolecularWeight: 279.40104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CNN(C1=S)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCN1CNN(C1=S)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C14H21N3OS/c1-3-4-9-16-11-15-17(14(16)19)10-12-5-7-13(18-2)8-6-12/h5-8,15H,3-4,9-11H2,1-2H3