3-(3-methoxypropyl)-5-methyl-7-phenyl-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(3-methoxypropyl)-5-methyl-7-phenyl-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 3-(3-methoxypropyl)-5-methyl-7-phenyl-2-thioxo-1H-pyrrolo[3,2-d]pyrimidin-4-one CAS Name: 3-(3-methoxypropyl)-5-methyl-7-phenyl-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-(3-methoxypropyl)-5-methyl-7-phenyl-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 3-(3-methoxypropyl)-5-methyl-7-phenyl-2-thioxo-1H-pyrrolo[3,2-d]pyrimidin-4-one Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C(=O)N(C(=S)N2)CCCOC)C3=CC=CC=C3

Isomeric SMILES

CN1C=C(C2=C1C(=O)N(C(=S)N2)CCCOC)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3O2S/c1-19-11-13(12-7-4-3-5-8-12)14-15(19)16(21)20(17(23)18-14)9-6-10-22-2/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,18,23)