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

Systemtic Name: 2-[3-(4-ethylphenyl)-5-methyl-4-oxidanylidene-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-N-(2-methoxy-5-methyl-phenyl)ethanamide Openeye Name: 2-[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-N-(2-methoxy-5-methyl-phenyl)acetamide CAS Name: 2-[[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenyl-2-pyrrolo[3,2-d]pyrimidinyl]thio]-N-(2-methoxy-5-methylphenyl)acetamide IUPAC Name: 2-[3-(4-ethylphenyl)-5-methyl-4-oxo-7-phenylpyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl-N-(2-methoxy-5-methylphenyl)acetamide Traditional Name: 2-[[3-(4-ethylphenyl)-4-keto-5-methyl-7-phenyl-pyrrolo[3,2-d]pyrimidin-2-yl]thio]-N-(2-methoxy-5-methyl-phenyl)acetamide Formula: C31H30N4O3S MolecularWeight: 538.6599

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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=C(C=CC(=C5)C)OC

Isomeric SMILES

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

InChI

InChI=1S/C31H30N4O3S/c1-5-21-12-14-23(15-13-21)35-30(37)29-28(24(18-34(29)3)22-9-7-6-8-10-22)33-31(35)39-19-27(36)32-25-17-20(2)11-16-26(25)38-4/h6-18H,5,19H2,1-4H3,(H,32,36)