2-(4-fluorophenyl)-N-[2-(3-methoxy-4-pent-2-ynoxy-phenyl)ethyl]-2-prop-2-ynoxy-ethanethioamide

Systemtic Name: 2-(4-fluorophenyl)-N-[2-(3-methoxy-4-pent-2-ynoxy-phenyl)ethyl]-2-prop-2-ynoxy-ethanethioamide Openeye Name: 2-(4-fluorophenyl)-N-[2-(3-methoxy-4-pent-2-ynoxy-phenyl)ethyl]-2-prop-2-ynoxy-thioacetamide CAS Name: 2-(4-fluorophenyl)-N-[2-(3-methoxy-4-pent-2-ynoxyphenyl)ethyl]-2-prop-2-ynoxyethanethioamide IUPAC Name: 2-(4-fluorophenyl)-N-[2-(3-methoxy-4-pent-2-ynoxyphenyl)ethyl]-2-prop-2-ynoxyethanethioamide Traditional Name: 2-(4-fluorophenyl)-N-[2-(3-methoxy-4-pent-2-ynoxy-phenyl)ethyl]-2-propargyloxy-thioacetamide Formula: C25H26FNO3S MolecularWeight: 439.542243

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCOC1=C(C=C(C=C1)CCNC(=S)C(C2=CC=C(C=C2)F)OCC#C)OC

Isomeric SMILES

CCC#CCOC1=C(C=C(C=C1)CCNC(=S)C(C2=CC=C(C=C2)F)OCC#C)OC

InChI

InChI=1S/C25H26FNO3S/c1-4-6-7-17-29-22-13-8-19(18-23(22)28-3)14-15-27-25(31)24(30-16-5-2)20-9-11-21(26)12-10-20/h2,8-13,18,24H,4,14-17H2,1,3H3,(H,27,31)