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

Systemtic Name: 2-[(3-cyclopropyl-4-oxidanylidene-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[(3-cyclopropyl-4-oxo-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[(3-cyclopropyl-4-oxo-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)thio]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[(3-cyclopropyl-4-oxo-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[(3-cyclopropyl-4-keto-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)thio]-N-p-anisyl-acetamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2C4CC4)NC=C3C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2C4CC4)NC=C3C5=CC=CC=C5

InChI

InChI=1S/C25H24N4O3S/c1-32-19-11-7-16(8-12-19)13-26-21(30)15-33-25-28-22-20(17-5-3-2-4-6-17)14-27-23(22)24(31)29(25)18-9-10-18/h2-8,11-12,14,18,27H,9-10,13,15H2,1H3,(H,26,30)