2-[[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-oxidanyl-methylidene]-1-benzothiophen-3-one

Systemtic Name: 2-[[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-oxidanyl-methylidene]-1-benzothiophen-3-one Openeye Name: 2-[hydroxy-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methylene]benzothiophen-3-one CAS Name: 2-[hydroxy-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-1-benzothiophen-3-one IUPAC Name: 2-[hydroxy-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-benzothiophen-3-one Traditional Name: 2-[hydroxy-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]methylene]benzothiophen-3-one Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCOC)C)C(=C2C(=O)C3=CC=CC=C3S2)O

Isomeric SMILES

CC1=CC(=C(N1CCOC)C)C(=C2C(=O)C3=CC=CC=C3S2)O

InChI

InChI=1S/C18H19NO3S/c1-11-10-14(12(2)19(11)8-9-22-3)17(21)18-16(20)13-6-4-5-7-15(13)23-18/h4-7,10,21H,8-9H2,1-3H3