3-[(5-ethanoyl-2-methoxy-phenyl)methyl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(5-ethanoyl-2-methoxy-phenyl)methyl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(5-acetyl-2-methoxy-phenyl)methyl]-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(5-acetyl-2-methoxyphenyl)methyl]-2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(5-acetyl-2-methoxyphenyl)methyl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(5-acetyl-2-methoxy-benzyl)-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C25H26N3O4S2+ MolecularWeight: 496.62164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CN2C(=NC3=C(C2=O)C(=CS3)C4=CC=CS4)C[NH+]5CCOCC5

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CN2C(=NC3=C(C2=O)C(=CS3)C4=CC=CS4)C[NH+]5CCOCC5

InChI

InChI=1S/C25H25N3O4S2/c1-16(29)17-5-6-20(31-2)18(12-17)13-28-22(14-27-7-9-32-10-8-27)26-24-23(25(28)30)19(15-34-24)21-4-3-11-33-21/h3-6,11-12,15H,7-10,13-14H2,1-2H3/p+1