2-[3-(4-ethylphenyl)-5-methyl-4-oxidanylidene-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[3-(4-ethylphenyl)-5-methyl-4-oxidanylidene-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenyl-2-pyrrolo[3,2-d]pyrimidinyl]thio]-N-phenylacetamide IUPAC Name: 2-[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenylpyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[3-(4-ethylphenyl)-4-keto-5-methyl-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]thio]-N-phenyl-acetamide Formula: C29H26N4O2S MolecularWeight: 494.60734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=C(C(=CN3C)C4=CC=CC=C4)N=C2SCC(=O)NC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=C(C(=CN3C)C4=CC=CC=C4)N=C2SCC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C29H26N4O2S/c1-3-20-14-16-23(17-15-20)33-28(35)27-26(24(18-32(27)2)21-10-6-4-7-11-21)31-29(33)36-19-25(34)30-22-12-8-5-9-13-22/h4-18H,3,19H2,1-2H3,(H,30,34)