5-(3-nitrophenyl)-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3-nitrophenyl)-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3-nitrophenyl)-3-(phenylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-benzyl-5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C19H13N3O3S MolecularWeight: 363.38982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O3S/c23-19-17-16(14-7-4-8-15(9-14)22(24)25)11-26-18(17)20-12-21(19)10-13-5-2-1-3-6-13/h1-9,11-12H,10H2