2-[[4-(2-chloranylprop-2-enyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(2-chloranylprop-2-enyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[4-(2-chloroallyl)piperazin-1-yl]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-(2-chloroprop-2-enyl)-1-piperazinyl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[4-(2-chloroprop-2-enyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[4-(2-chloroallyl)piperazino]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H19ClN4OS2 MolecularWeight: 406.95266

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)Cl

Isomeric SMILES

C=C(CN1CCN(CC1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)Cl

InChI

InChI=1S/C18H19ClN4OS2/c1-12(19)9-22-4-6-23(7-5-22)10-15-20-17(24)16-13(11-26-18(16)21-15)14-3-2-8-25-14/h2-3,8,11H,1,4-7,9-10H2,(H,20,21,24)