5-(tert-butylamino)-3-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(tert-butylamino)-3-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(tert-butylamino)-3-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(tert-butylamino)-3-[[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(tert-butylamino)-3-[[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(tert-butylamino)-3-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione Formula: C24H28N6S2 MolecularWeight: 464.64932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NN(C(=S)S1)CN(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC1=NN(C(=S)S1)CN(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N6S2/c1-24(2,3)25-22-27-30(23(31)32-22)17-28(4)15-19-16-29(20-13-9-6-10-14-20)26-21(19)18-11-7-5-8-12-18/h5-14,16H,15,17H2,1-4H3,(H,25,27)