2-nitro-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide

Systemtic Name: 2-nitro-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide Openeye Name: 2-nitro-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide CAS Name: 2-nitro-N-[[2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-nitro-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide Traditional Name: 2-nitro-N-[[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]phenyl]thiocarbamoyl]benzamide Formula: C26H17N5O3S3 MolecularWeight: 543.63988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC4=CC=CC=C4NC(=S)NC(=O)C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC4=CC=CC=C4NC(=S)NC(=O)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C26H17N5O3S3/c32-23(17-10-4-6-12-20(17)31(33)34)30-26(35)29-19-11-5-7-13-21(19)37-25-22-18(16-8-2-1-3-9-16)14-36-24(22)27-15-28-25/h1-15H,(H2,29,30,32,35)