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

Systemtic Name: N-(4-ethylphenyl)-2-[3-(4-ethylphenyl)-5-methyl-4-oxidanylidene-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethylphenyl)-2-[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(4-ethylphenyl)-2-[[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenyl-2-pyrrolo[3,2-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(4-ethylphenyl)-2-[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenylpyrrolo[3,2-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(4-ethylphenyl)-2-[[3-(4-ethylphenyl)-4-keto-5-methyl-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]thio]acetamide Formula: C31H30N4O2S MolecularWeight: 522.6605

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)CC)N(C=C3C5=CC=CC=C5)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)CC)N(C=C3C5=CC=CC=C5)C

InChI

InChI=1S/C31H30N4O2S/c1-4-21-11-15-24(16-12-21)32-27(36)20-38-31-33-28-26(23-9-7-6-8-10-23)19-34(3)29(28)30(37)35(31)25-17-13-22(5-2)14-18-25/h6-19H,4-5,20H2,1-3H3,(H,32,36)