2-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Openeye Name: 2-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]thiazole CAS Name: 2-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-1-piperazin-1-iumyl]methyl]thiazole IUPAC Name: 2-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]-1,3-thiazole Traditional Name: 2-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-ium-1-yl]methyl]thiazole Formula: C21H24N5S+ MolecularWeight: 378.51376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N=C2N3CC[NH+](CC3)CC4=NC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)N=C(N=C2N3CC[NH+](CC3)CC4=NC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C21H23N5S/c1-2-5-16(6-3-1)20-23-18-8-4-7-17(18)21(24-20)26-12-10-25(11-13-26)15-19-22-9-14-27-19/h1-3,5-6,9,14H,4,7-8,10-13,15H2/p+1