4-[4-[5-tert-butyl-2-(phenylmethyl)pyrazol-3-yl]-1,3-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[4-[5-tert-butyl-2-(phenylmethyl)pyrazol-3-yl]-1,3-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[4-(2-benzyl-5-tert-butyl-pyrazol-3-yl)thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[4-[5-tert-butyl-2-(phenylmethyl)-3-pyrazolyl]-2-thiazolyl]-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[4-(2-benzyl-5-tert-butylpyrazol-3-yl)-1,3-thiazol-2-yl]-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[4-(2-benzyl-5-tert-butyl-pyrazol-3-yl)thiazol-2-yl]-5-(methylthio)thiophene-2-carboxamidine Formula: C23H25N5S3 MolecularWeight: 467.6731

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C2=CSC(=N2)C3=C(SC(=C3)C(=N)N)SC)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C2=CSC(=N2)C3=C(SC(=C3)C(=N)N)SC)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N5S3/c1-23(2,3)19-11-17(28(27-19)12-14-8-6-5-7-9-14)16-13-30-21(26-16)15-10-18(20(24)25)31-22(15)29-4/h5-11,13H,12H2,1-4H3,(H3,24,25)