(3E)-3-[[(3-chlorophenyl)amino]-oxidanyl-methylidene]-2,2-dimethyl-thiochromen-4-one

Systemtic Name: (3E)-3-[[(3-chlorophenyl)amino]-oxidanyl-methylidene]-2,2-dimethyl-thiochromen-4-one Openeye Name: (3E)-3-[(3-chloroanilino)-hydroxy-methylene]-2,2-dimethyl-thiochroman-4-one CAS Name: (3E)-3-[(3-chloroanilino)-hydroxymethylidene]-2,2-dimethyl-1-benzothiopyran-4-one IUPAC Name: (3E)-3-[(3-chloroanilino)-hydroxymethylidene]-2,2-dimethylthiochromen-4-one Traditional Name: (3E)-3-[(3-chloroanilino)-hydroxy-methylene]-2,2-dimethyl-thiochroman-4-one Formula: C18H16ClNO2S MolecularWeight: 345.84314

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(NC2=CC(=CC=C2)Cl)O)C(=O)C3=CC=CC=C3S1)C

Isomeric SMILES

CC1(/C(=C(\NC2=CC(=CC=C2)Cl)/O)/C(=O)C3=CC=CC=C3S1)C

InChI

InChI=1S/C18H16ClNO2S/c1-18(2)15(16(21)13-8-3-4-9-14(13)23-18)17(22)20-12-7-5-6-11(19)10-12/h3-10,20,22H,1-2H3/b17-15+