2-(3-azanyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloranyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloranyl-5-nitro-phenyl)ethanamide Openeye Name: 2-(3-amino-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloro-5-nitro-phenyl)acetamide CAS Name: 2-[(3-amino-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(2-chloro-5-nitrophenyl)acetamide IUPAC Name: 2-(3-amino-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-chloro-5-nitrophenyl)acetamide Traditional Name: 2-[(3-amino-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-chloro-5-nitro-phenyl)acetamide Formula: C20H14ClN5O4S2 MolecularWeight: 487.93926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl)N

InChI

InChI=1S/C20H14ClN5O4S2/c21-14-7-6-12(26(29)30)8-15(14)23-16(27)10-32-20-24-18-17(19(28)25(20)22)13(9-31-18)11-4-2-1-3-5-11/h1-9H,10,22H2,(H,23,27)