4-(2-fluorophenyl)-6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidine; methanesulfonic acid

Systemtic Name: 4-(2-fluorophenyl)-6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidine; methanesulfonic acid Openeye Name: 4-(2-fluorophenyl)-6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidine; methanesulfonic acid CAS Name: 4-(2-fluorophenyl)-6-methyl-2-(1-piperazinyl)thieno[2,3-d]pyrimidine; methanesulfonic acid IUPAC Name: 4-(2-fluorophenyl)-6-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidine; methanesulfonic acid Traditional Name: 4-(2-fluorophenyl)-6-methyl-2-piperazino-thieno[2,3-d]pyrimidine; mesylic acid Formula: C18H21FN4O3S2 MolecularWeight: 424.512743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N=C(N=C2S1)N3CCNCC3)C4=CC=CC=C4F.CS(=O)(=O)O

Isomeric SMILES

CC1=CC2=C(N=C(N=C2S1)N3CCNCC3)C4=CC=CC=C4F.CS(=O)(=O)O

InChI

InChI=1S/C17H17FN4S.CH4O3S/c1-11-10-13-15(12-4-2-3-5-14(12)18)20-17(21-16(13)23-11)22-8-6-19-7-9-22;1-5(2,3)4/h2-5,10,19H,6-9H2,1H3;1H3,(H,2,3,4)