N-[4-[(3-methylphenyl)methyl]-6-phenylsulfanyl-pyrimidin-2-yl]-1H-indazol-3-amine

Systemtic Name: N-[4-[(3-methylphenyl)methyl]-6-phenylsulfanyl-pyrimidin-2-yl]-1H-indazol-3-amine Openeye Name: N-[4-(m-tolylmethyl)-6-phenylsulfanyl-pyrimidin-2-yl]-1H-indazol-3-amine CAS Name: N-[4-[(3-methylphenyl)methyl]-6-(phenylthio)-2-pyrimidinyl]-1H-indazol-3-amine IUPAC Name: N-[4-[(3-methylphenyl)methyl]-6-phenylsulfanylpyrimidin-2-yl]-1H-indazol-3-amine Traditional Name: 1H-indazol-3-yl-[4-(3-methylbenzyl)-6-(phenylthio)pyrimidin-2-yl]amine Formula: C25H21N5S MolecularWeight: 423.53274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=CC(=NC(=N2)NC3=NNC4=CC=CC=C43)SC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)CC2=CC(=NC(=N2)NC3=NNC4=CC=CC=C43)SC5=CC=CC=C5

InChI

InChI=1S/C25H21N5S/c1-17-8-7-9-18(14-17)15-19-16-23(31-20-10-3-2-4-11-20)27-25(26-19)28-24-21-12-5-6-13-22(21)29-30-24/h2-14,16H,15H2,1H3,(H2,26,27,28,29,30)