2-piperazin-4-ium-1-yl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-piperazin-4-ium-1-yl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-piperazin-4-ium-1-yl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-(1-piperazin-4-iumyl)-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-piperazin-4-ium-1-yl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-piperazin-4-ium-1-yl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C17H23N4OS+ MolecularWeight: 331.45572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1N3CC[NH2+]CC3)SC4=C2CCCC4

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1N3CC[NH2+]CC3)SC4=C2CCCC4

InChI

InChI=1S/C17H22N4OS/c1-2-9-21-16(22)14-12-5-3-4-6-13(12)23-15(14)19-17(21)20-10-7-18-8-11-20/h2,18H,1,3-11H2/p+1