5-ethyl-4-ethylsulfanyl-2-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbaldehyde

Systemtic Name: 5-ethyl-4-ethylsulfanyl-2-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbaldehyde Openeye Name: 5-ethyl-4-ethylsulfanyl-2-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbaldehyde CAS Name: 5-ethyl-4-(ethylthio)-2-phenyl-7-pyrrolo[3,2-d]pyrimidinecarboxaldehyde IUPAC Name: 5-ethyl-4-ethylsulfanyl-2-phenylpyrrolo[3,2-d]pyrimidine-7-carbaldehyde Traditional Name: 5-ethyl-4-(ethylthio)-2-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbaldehyde Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C(=NC(=N2)C3=CC=CC=C3)SCC)C=O

Isomeric SMILES

CCN1C=C(C2=C1C(=NC(=N2)C3=CC=CC=C3)SCC)C=O

InChI

InChI=1S/C17H17N3OS/c1-3-20-10-13(11-21)14-15(20)17(22-4-2)19-16(18-14)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3