4-(2-fluorophenyl)-6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidine hydrate hydrochloride

Systemtic Name: 4-(2-fluorophenyl)-6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidine hydrate hydrochloride Openeye Name: 4-(2-fluorophenyl)-6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidine hydrate hydrochloride CAS Name: 4-(2-fluorophenyl)-6-methyl-2-(1-piperazinyl)thieno[2,3-d]pyrimidine hydrate hydrochloride IUPAC Name: 4-(2-fluorophenyl)-6-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidine hydrate hydrochloride Traditional Name: 4-(2-fluorophenyl)-6-methyl-2-piperazino-thieno[2,3-d]pyrimidine hydrate hydrochloride Formula: C17H20ClFN4OS MolecularWeight: 382.883303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17FN4S.ClH.H2O/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;;/h2-5,10,19H,6-9H2,1H3;1H;1H2