2-[(E)-2-(4-chloranyl-3-nitro-phenyl)ethenyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(E)-2-(4-chloranyl-3-nitro-phenyl)ethenyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(E)-2-(4-chloro-3-nitro-phenyl)vinyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(E)-2-(4-chloro-3-nitrophenyl)ethenyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(E)-2-(4-chloro-3-nitrophenyl)ethenyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(E)-2-(4-chloro-3-nitro-phenyl)vinyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H10ClN3O3S2 MolecularWeight: 415.8733

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CSC3=C2C(=O)NC(=N3)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C2=CSC3=C2C(=O)NC(=N3)/C=C/C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H10ClN3O3S2/c19-12-5-3-10(8-13(12)22(24)25)4-6-15-20-17(23)16-11(9-27-18(16)21-15)14-2-1-7-26-14/h1-9H,(H,20,21,23)/b6-4+