4-piperazin-4-ium-1-yl-[1]benzothiolo[3,2-d]pyrimidine

Systemtic Name: 4-piperazin-4-ium-1-yl-[1]benzothiolo[3,2-d]pyrimidine Openeye Name: 4-piperazin-4-ium-1-ylbenzothiopheno[3,2-d]pyrimidine CAS Name: 4-(1-piperazin-4-iumyl)-[1]benzothiolo[3,2-d]pyrimidine IUPAC Name: 4-piperazin-4-ium-1-yl-[1]benzothiolo[3,2-d]pyrimidine Traditional Name: 4-piperazin-4-ium-1-ylbenzothiopheno[3,2-d]pyrimidine Formula: C14H15N4S+ MolecularWeight: 271.3607

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=NC3=C2SC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=NC3=C2SC4=CC=CC=C43

InChI

InChI=1S/C14H14N4S/c1-2-4-11-10(3-1)12-13(19-11)14(17-9-16-12)18-7-5-15-6-8-18/h1-4,9,15H,5-8H2/p+1