3-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-5-propylsulfanyl-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-5-propylsulfanyl-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-5-propylsulfanyl-1,3,4-thiadiazole-2-thione CAS Name: 3-[[methyl-[(1-phenyl-4-pyrazolyl)methyl]amino]methyl]-5-(propylthio)-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-5-propylsulfanyl-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-5-(propylthio)-1,3,4-thiadiazole-2-thione Formula: C17H21N5S3 MolecularWeight: 391.57714

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN(C(=S)S1)CN(C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCCSC1=NN(C(=S)S1)CN(C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N5S3/c1-3-9-24-16-19-22(17(23)25-16)13-20(2)11-14-10-18-21(12-14)15-7-5-4-6-8-15/h4-8,10,12H,3,9,11,13H2,1-2H3