4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenylsulfanyl-pyrimidin-2-amine

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenylsulfanyl-pyrimidin-2-amine Openeye Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenylsulfanyl-pyrimidin-2-amine CAS Name: 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-6-(phenylthio)-2-pyrimidinamine IUPAC Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-phenylsulfanylpyrimidin-2-amine Traditional Name: [4-[4-(2,3-dimethylphenyl)piperazino]-6-(phenylthio)pyrimidin-2-yl]amine Formula: C22H25N5S MolecularWeight: 391.5324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=CC(=NC(=N3)N)SC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=CC(=NC(=N3)N)SC4=CC=CC=C4)C

InChI

InChI=1S/C22H25N5S/c1-16-7-6-10-19(17(16)2)26-11-13-27(14-12-26)20-15-21(25-22(23)24-20)28-18-8-4-3-5-9-18/h3-10,15H,11-14H2,1-2H3,(H2,23,24,25)