[3-[(2-methylpropan-2-yl)oxy]phenyl]-(1-oxidanylidene-3-phenyl-6-propoxy-1-benzothiophen-2-yl)methanone

Systemtic Name: [3-[(2-methylpropan-2-yl)oxy]phenyl]-(1-oxidanylidene-3-phenyl-6-propoxy-1-benzothiophen-2-yl)methanone Openeye Name: (3-tert-butoxyphenyl)-(1-oxo-3-phenyl-6-propoxy-benzothiophen-2-yl)methanone CAS Name: [3-[(2-methylpropan-2-yl)oxy]phenyl]-(1-oxo-3-phenyl-6-propoxy-1-benzothiophen-2-yl)methanone IUPAC Name: [3-[(2-methylpropan-2-yl)oxy]phenyl]-(1-oxo-3-phenyl-6-propoxy-1-benzothiophen-2-yl)methanone Traditional Name: (3-tert-butoxyphenyl)-(1-keto-3-phenyl-6-propoxy-benzothiophen-2-yl)methanone Formula: C28H28O4S MolecularWeight: 460.58452

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(=C(S2=O)C(=O)C3=CC(=CC=C3)OC(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(=C(S2=O)C(=O)C3=CC(=CC=C3)OC(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C28H28O4S/c1-5-16-31-21-14-15-23-24(18-21)33(30)27(25(23)19-10-7-6-8-11-19)26(29)20-12-9-13-22(17-20)32-28(2,3)4/h6-15,17-18H,5,16H2,1-4H3