propyl 3-(2-methylsulfanyl-4-oxidanylidene-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: propyl 3-(2-methylsulfanyl-4-oxidanylidene-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: propyl 3-(2-methylsulfanyl-4-oxo-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-[2-(methylthio)-4-oxo-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-3-yl]propanoic acid propyl ester IUPAC Name: propyl 3-(2-methylsulfanyl-4-oxo-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-[4-keto-2-(methylthio)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-3-yl]propionic acid propyl ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCN1C(=O)C2=C(NC=C2C3=CC=CC=C3)N=C1SC

Isomeric SMILES

CCCOC(=O)CCN1C(=O)C2=C(NC=C2C3=CC=CC=C3)N=C1SC

InChI

InChI=1S/C19H21N3O3S/c1-3-11-25-15(23)9-10-22-18(24)16-14(13-7-5-4-6-8-13)12-20-17(16)21-19(22)26-2/h4-8,12,20H,3,9-11H2,1-2H3