4-methylsulfanyl-6-phenyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidin-2-one

Systemtic Name: 4-methylsulfanyl-6-phenyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidin-2-one Openeye Name: 4-methylsulfanyl-6-phenyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidin-2-one CAS Name: 4-(methylthio)-6-phenyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidin-2-one IUPAC Name: 4-methylsulfanyl-6-phenyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidin-2-one Traditional Name: 4-(methylthio)-6-phenyl-1-propyl-5H-pyrrolo[3,2-d]pyrimidin-2-one Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC1=O)SC)NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCCN1C2=C(C(=NC1=O)SC)NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H17N3OS/c1-3-9-19-13-10-12(11-7-5-4-6-8-11)17-14(13)15(21-2)18-16(19)20/h4-8,10,17H,3,9H2,1-2H3