4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine CAS Name: 4-[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]-6-ethylthieno[2,3-d]pyrimidine IUPAC Name: 4-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-6-ethylthieno[2,3-d]pyrimidine Traditional Name: 4-[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine Formula: C19H22ClN4S+ MolecularWeight: 373.92278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H21ClN4S/c1-2-16-11-17-18(21-13-22-19(17)25-16)24-9-7-23(8-10-24)12-14-3-5-15(20)6-4-14/h3-6,11,13H,2,7-10,12H2,1H3/p+1