3-(furan-2-ylmethyl)-2-methylsulfanyl-8-nitro-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-2-methylsulfanyl-8-nitro-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-(2-furylmethyl)-2-methylsulfanyl-8-nitro-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-(2-furanylmethyl)-2-(methylthio)-8-nitro-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-(furan-2-ylmethyl)-2-methylsulfanyl-8-nitro-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-(2-furfuryl)-2-(methylthio)-8-nitro-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C16H11N3O4S2 MolecularWeight: 373.40624

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C(=O)N1CC3=CC=CO3)SC4=C2C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CSC1=NC2=C(C(=O)N1CC3=CC=CO3)SC4=C2C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O4S2/c1-24-16-17-13-11-7-9(19(21)22)4-5-12(11)25-14(13)15(20)18(16)8-10-3-2-6-23-10/h2-7H,8H2,1H3