5,6-dimethyl-4-(4-phenylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-4-(4-phenylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 5,6-dimethyl-4-(4-phenylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine CAS Name: 5,6-dimethyl-4-(4-phenyl-1-piperazin-4-iumyl)thieno[2,3-d]pyrimidine IUPAC Name: 5,6-dimethyl-4-(4-phenylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 5,6-dimethyl-4-(4-phenylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Formula: C18H21N4S+ MolecularWeight: 325.45114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CC[NH+](CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CC[NH+](CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C18H20N4S/c1-13-14(2)23-18-16(13)17(19-12-20-18)22-10-8-21(9-11-22)15-6-4-3-5-7-15/h3-7,12H,8-11H2,1-2H3/p+1