[3-tert-butyl-5-[(2-hydroxyethylamino)methyl]-4-oxidanyl-thiophen-2-yl]-phenyl-methanone

Systemtic Name: [3-tert-butyl-5-[(2-hydroxyethylamino)methyl]-4-oxidanyl-thiophen-2-yl]-phenyl-methanone Openeye Name: [3-tert-butyl-4-hydroxy-5-[(2-hydroxyethylamino)methyl]-2-thienyl]-phenyl-methanone CAS Name: [3-tert-butyl-4-hydroxy-5-[(2-hydroxyethylamino)methyl]-2-thiophenyl]-phenylmethanone IUPAC Name: [3-tert-butyl-4-hydroxy-5-[(2-hydroxyethylamino)methyl]thiophen-2-yl]-phenylmethanone Traditional Name: [3-tert-butyl-4-hydroxy-5-[(2-hydroxyethylamino)methyl]-2-thienyl]-phenyl-methanone Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=C1O)CNCCO)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=C(SC(=C1O)CNCCO)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H23NO3S/c1-18(2,3)14-16(22)13(11-19-9-10-20)23-17(14)15(21)12-7-5-4-6-8-12/h4-8,19-20,22H,9-11H2,1-3H3