1-(2,4-dimethylphenyl)-5-prop-2-ynylsulfanyl-1,2,3,4-tetrazole

Systemtic Name: 1-(2,4-dimethylphenyl)-5-prop-2-ynylsulfanyl-1,2,3,4-tetrazole Openeye Name: 1-(2,4-dimethylphenyl)-5-prop-2-ynylsulfanyl-tetrazole CAS Name: 1-(2,4-dimethylphenyl)-5-(prop-2-ynylthio)tetrazole IUPAC Name: 1-(2,4-dimethylphenyl)-5-prop-2-ynylsulfanyltetrazole Traditional Name: 1-(2,4-dimethylphenyl)-5-(propargylthio)tetrazole Formula: C12H12N4S MolecularWeight: 244.31548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=N2)SCC#C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=N2)SCC#C)C

InChI

InChI=1S/C12H12N4S/c1-4-7-17-12-13-14-15-16(12)11-6-5-9(2)8-10(11)3/h1,5-6,8H,7H2,2-3H3