N-naphthalen-1-yl-2-[[3-(4-nitrophenyl)-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-naphthalen-1-yl-2-[[3-(4-nitrophenyl)-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]ethanamide Openeye Name: N-(1-naphthyl)-2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide CAS Name: N-(1-naphthalenyl)-2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]thio]acetamide IUPAC Name: N-naphthalen-1-yl-2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[4-keto-3-(4-nitrophenyl)-5H-pyrimid[5,4-b]indol-2-yl]thio]-N-(1-naphthyl)acetamide Formula: C28H19N5O4S MolecularWeight: 521.54656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)[N+](=O)[O-])NC6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)[N+](=O)[O-])NC6=CC=CC=C64

InChI

InChI=1S/C28H19N5O4S/c34-24(29-22-11-5-7-17-6-1-2-8-20(17)22)16-38-28-31-25-21-9-3-4-10-23(21)30-26(25)27(35)32(28)18-12-14-19(15-13-18)33(36)37/h1-15,30H,16H2,(H,29,34)