5,6-dimethyl-4-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-yl]-2-thiophen-2-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-4-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-yl]-2-thiophen-2-yl-thieno[2,3-d]pyrimidine Openeye Name: 5,6-dimethyl-4-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-yl]-2-(2-thienyl)thieno[2,3-d]pyrimidine CAS Name: 5,6-dimethyl-4-[4-[2-(1-pyrrolidin-1-iumyl)ethyl]-1-piperazinyl]-2-thiophen-2-ylthieno[2,3-d]pyrimidine IUPAC Name: 5,6-dimethyl-4-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazin-1-yl]-2-thiophen-2-ylthieno[2,3-d]pyrimidine Traditional Name: 5,6-dimethyl-4-[4-(2-pyrrolidin-1-ium-1-ylethyl)piperazino]-2-(2-thienyl)thieno[2,3-d]pyrimidine Formula: C22H30N5S2+ MolecularWeight: 428.6371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)CC[NH+]4CCCC4)C5=CC=CS5)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)CC[NH+]4CCCC4)C5=CC=CS5)C

InChI

InChI=1S/C22H29N5S2/c1-16-17(2)29-22-19(16)21(23-20(24-22)18-6-5-15-28-18)27-13-11-26(12-14-27)10-9-25-7-3-4-8-25/h5-6,15H,3-4,7-14H2,1-2H3/p+1