2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-2-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]-1H-pyrimidin-6-one Formula: C14H11N3O3S MolecularWeight: 301.32044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=NC(=CC(=O)N3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=NC(=CC(=O)N3)O

InChI

InChI=1S/C14H11N3O3S/c18-11(7-21-14-16-12(19)5-13(20)17-14)9-6-15-10-4-2-1-3-8(9)10/h1-6,15H,7H2,(H2,16,17,19,20)