2-(6-chloranyl-2-oxidanylidene-chromen-3-yl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(6-chloranyl-2-oxidanylidene-chromen-3-yl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-(6-chloro-2-oxo-chromen-3-yl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-(6-chloro-2-oxo-1-benzopyran-3-yl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-(6-chloro-2-oxochromen-3-yl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-(6-chloro-2-keto-chromen-3-yl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C19H13ClN2O3S MolecularWeight: 384.83612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4=CC5=C(C=CC(=C5)Cl)OC4=O

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4=CC5=C(C=CC(=C5)Cl)OC4=O

InChI

InChI=1S/C19H13ClN2O3S/c20-10-5-6-13-9(7-10)8-12(19(24)25-13)16-21-17(23)15-11-3-1-2-4-14(11)26-18(15)22-16/h5-8H,1-4H2,(H,21,22,23)