6-[5-azanyl-1-ethyl-3-(2-fluorophenyl)pyrazol-4-yl]-N-[(2R)-butan-2-yl]-1,3-benzothiazol-2-amine

Systemtic Name: 6-[5-azanyl-1-ethyl-3-(2-fluorophenyl)pyrazol-4-yl]-N-[(2R)-butan-2-yl]-1,3-benzothiazol-2-amine Openeye Name: 6-[5-amino-1-ethyl-3-(2-fluorophenyl)pyrazol-4-yl]-N-[(1R)-1-methylpropyl]-1,3-benzothiazol-2-amine CAS Name: 6-[5-amino-1-ethyl-3-(2-fluorophenyl)-4-pyrazolyl]-N-[(2R)-butan-2-yl]-1,3-benzothiazol-2-amine IUPAC Name: 6-[5-amino-1-ethyl-3-(2-fluorophenyl)pyrazol-4-yl]-N-[(2R)-butan-2-yl]-1,3-benzothiazol-2-amine Traditional Name: [6-[5-amino-1-ethyl-3-(2-fluorophenyl)pyrazol-4-yl]-1,3-benzothiazol-2-yl]-[(1R)-1-methylpropyl]amine Formula: C22H24FN5S MolecularWeight: 409.522863

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC2=C(S1)C=C(C=C2)C3=C(N(N=C3C4=CC=CC=C4F)CC)N

Isomeric SMILES

CC[C@@H](C)NC1=NC2=C(S1)C=C(C=C2)C3=C(N(N=C3C4=CC=CC=C4F)CC)N

InChI

InChI=1S/C22H24FN5S/c1-4-13(3)25-22-26-17-11-10-14(12-18(17)29-22)19-20(27-28(5-2)21(19)24)15-8-6-7-9-16(15)23/h6-13H,4-5,24H2,1-3H3,(H,25,26)/t13-/m1/s1