5,6-dimethyl-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-dimethyl-2-[[4-phenyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-2-[[[4-phenyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5,6-dimethyl-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-2-[[(4-phenyl-5-piperidino-1,2,4-triazol-3-yl)thio]methyl]thieno[2,3-d]pyrimidin-4-yl]amine Formula: C22H25N7S2 MolecularWeight: 451.6108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)CSC3=NN=C(N3C4=CC=CC=C4)N5CCCCC5)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)CSC3=NN=C(N3C4=CC=CC=C4)N5CCCCC5)C

InChI

InChI=1S/C22H25N7S2/c1-14-15(2)31-20-18(14)19(23)24-17(25-20)13-30-22-27-26-21(28-11-7-4-8-12-28)29(22)16-9-5-3-6-10-16/h3,5-6,9-10H,4,7-8,11-13H2,1-2H3,(H2,23,24,25)