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

Systemtic Name: 6-azanyl-2-[2-(3-oxidanyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(3-hydroxybenzothiophen-2-yl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-(3-hydroxy-1-benzothiophen-2-yl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(3-hydroxy-1-benzothiophen-2-yl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-(3-hydroxybenzothiophen-2-yl)-2-keto-ethyl]thio]-1H-pyrimidin-4-one Formula: C14H11N3O3S2 MolecularWeight: 333.38544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)CSC3=NC(=O)C=C(N3)N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)CSC3=NC(=O)C=C(N3)N)O

InChI

InChI=1S/C14H11N3O3S2/c15-10-5-11(19)17-14(16-10)21-6-8(18)13-12(20)7-3-1-2-4-9(7)22-13/h1-5,20H,6H2,(H3,15,16,17,19)