4-(1,3-benzothiazol-2-yl)-5-(propan-2-ylsulfanylmethyl)-1H-pyrazol-3-amine

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-5-(propan-2-ylsulfanylmethyl)-1H-pyrazol-3-amine Openeye Name: 4-(1,3-benzothiazol-2-yl)-5-(isopropylsulfanylmethyl)-1H-pyrazol-3-amine CAS Name: 4-(1,3-benzothiazol-2-yl)-5-[(propan-2-ylthio)methyl]-1H-pyrazol-3-amine IUPAC Name: 4-(1,3-benzothiazol-2-yl)-5-(propan-2-ylsulfanylmethyl)-1H-pyrazol-3-amine Traditional Name: [4-(1,3-benzothiazol-2-yl)-5-[(isopropylthio)methyl]-1H-pyrazol-3-yl]amine Formula: C14H16N4S2 MolecularWeight: 304.43364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=C(C(=NN1)N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)SCC1=C(C(=NN1)N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H16N4S2/c1-8(2)19-7-10-12(13(15)18-17-10)14-16-9-5-3-4-6-11(9)20-14/h3-6,8H,7H2,1-2H3,(H3,15,17,18)