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

Systemtic Name: phenyl-[2-(4-propan-2-yloxyphenyl)-6-propoxy-1-benzothiophen-3-yl]methanone Openeye Name: [2-(4-isopropoxyphenyl)-6-propoxy-benzothiophen-3-yl]-phenyl-methanone CAS Name: phenyl-[2-(4-propan-2-yloxyphenyl)-6-propoxy-1-benzothiophen-3-yl]methanone IUPAC Name: phenyl-[2-(4-propan-2-yloxyphenyl)-6-propoxy-1-benzothiophen-3-yl]methanone Traditional Name: [2-(4-isopropoxyphenyl)-6-propoxy-benzothiophen-3-yl]-phenyl-methanone Formula: C27H26O3S MolecularWeight: 430.55854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26O3S/c1-4-16-29-22-14-15-23-24(17-22)31-27(20-10-12-21(13-11-20)30-18(2)3)25(23)26(28)19-8-6-5-7-9-19/h5-15,17-18H,4,16H2,1-3H3