3-(4-methoxyphenyl)-7-phenoxy-2-[4-(2-piperidin-1-ylethoxy)phenyl]sulfanyl-chromen-4-one

Systemtic Name: 3-(4-methoxyphenyl)-7-phenoxy-2-[4-(2-piperidin-1-ylethoxy)phenyl]sulfanyl-chromen-4-one Openeye Name: 3-(4-methoxyphenyl)-7-phenoxy-2-[4-[2-(1-piperidyl)ethoxy]phenyl]sulfanyl-chromen-4-one CAS Name: 3-(4-methoxyphenyl)-7-phenoxy-2-[[4-[2-(1-piperidinyl)ethoxy]phenyl]thio]-1-benzopyran-4-one IUPAC Name: 3-(4-methoxyphenyl)-7-phenoxy-2-[4-(2-piperidin-1-ylethoxy)phenyl]sulfanylchromen-4-one Traditional Name: 3-(4-methoxyphenyl)-7-phenoxy-2-[[4-(2-piperidinoethoxy)phenyl]thio]chromone Formula: C35H33NO5S MolecularWeight: 579.70522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC4=CC=CC=C4)SC5=CC=C(C=C5)OCCN6CCCCC6

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC4=CC=CC=C4)SC5=CC=C(C=C5)OCCN6CCCCC6

InChI

InChI=1S/C35H33NO5S/c1-38-26-12-10-25(11-13-26)33-34(37)31-19-16-29(40-28-8-4-2-5-9-28)24-32(31)41-35(33)42-30-17-14-27(15-18-30)39-23-22-36-20-6-3-7-21-36/h2,4-5,8-19,24H,3,6-7,20-23H2,1H3