[1-oxidanylidene-2-(4-propan-2-yloxyphenyl)-6-propoxy-1-benzothiophen-3-yl]-phenyl-methanone

Systemtic Name: [1-oxidanylidene-2-(4-propan-2-yloxyphenyl)-6-propoxy-1-benzothiophen-3-yl]-phenyl-methanone Openeye Name: [2-(4-isopropoxyphenyl)-1-oxo-6-propoxy-benzothiophen-3-yl]-phenyl-methanone CAS Name: [1-oxo-2-(4-propan-2-yloxyphenyl)-6-propoxy-1-benzothiophen-3-yl]-phenylmethanone IUPAC Name: [1-oxo-2-(4-propan-2-yloxyphenyl)-6-propoxy-1-benzothiophen-3-yl]-phenylmethanone Traditional Name: [2-(4-isopropoxyphenyl)-1-keto-6-propoxy-benzothiophen-3-yl]-phenyl-methanone Formula: C27H26O4S MolecularWeight: 446.55794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26O4S/c1-4-16-30-22-14-15-23-24(17-22)32(29)27(20-10-12-21(13-11-20)31-18(2)3)25(23)26(28)19-8-6-5-7-9-19/h5-15,17-18H,4,16H2,1-3H3