1-benzothiophen-3-yl-[4-[3-(butylamino)-2-oxidanyl-propoxy]-2-methoxy-6-(4-methoxyphenyl)phenyl]methanone

Systemtic Name: 1-benzothiophen-3-yl-[4-[3-(butylamino)-2-oxidanyl-propoxy]-2-methoxy-6-(4-methoxyphenyl)phenyl]methanone Openeye Name: benzothiophen-3-yl-[4-[3-(butylamino)-2-hydroxy-propoxy]-2-methoxy-6-(4-methoxyphenyl)phenyl]methanone CAS Name: 1-benzothiophen-3-yl-[4-[3-(butylamino)-2-hydroxypropoxy]-2-methoxy-6-(4-methoxyphenyl)phenyl]methanone IUPAC Name: 1-benzothiophen-3-yl-[4-[3-(butylamino)-2-hydroxypropoxy]-2-methoxy-6-(4-methoxyphenyl)phenyl]methanone Traditional Name: benzothiophen-3-yl-[4-[3-(butylamino)-2-hydroxy-propoxy]-2-methoxy-6-(4-methoxyphenyl)phenyl]methanone Formula: C30H33NO5S MolecularWeight: 519.65172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(COC1=CC(=C(C(=C1)C2=CC=C(C=C2)OC)C(=O)C3=CSC4=CC=CC=C43)OC)O

Isomeric SMILES

CCCCNCC(COC1=CC(=C(C(=C1)C2=CC=C(C=C2)OC)C(=O)C3=CSC4=CC=CC=C43)OC)O

InChI

InChI=1S/C30H33NO5S/c1-4-5-14-31-17-21(32)18-36-23-15-25(20-10-12-22(34-2)13-11-20)29(27(16-23)35-3)30(33)26-19-37-28-9-7-6-8-24(26)28/h6-13,15-16,19,21,31-32H,4-5,14,17-18H2,1-3H3