2-[[3-(4-chlorophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-[[3-(4-chlorophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-[[3-(4-chlorophenyl)-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-nitrophenyl)methyleneamino]acetamide CAS Name: 2-[[3-(4-chlorophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]thio]-N-[(4-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-[[3-(4-chlorophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-[[3-(4-chlorophenyl)-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]thio]-N-[(4-nitrobenzylidene)amino]acetamide Formula: C25H20ClN5O4S2 MolecularWeight: 554.0404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Cl)SCC(=O)NN=CC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Cl)SCC(=O)NN=CC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H20ClN5O4S2/c26-16-7-11-17(12-8-16)30-24(33)22-19-3-1-2-4-20(19)37-23(22)28-25(30)36-14-21(32)29-27-13-15-5-9-18(10-6-15)31(34)35/h5-13H,1-4,14H2,(H,29,32)