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

Systemtic Name: 2-(4-ethylphenyl)-N-[2-(3-methoxy-4-pent-2-ynoxy-phenyl)ethyl]-2-prop-2-ynoxy-ethanethioamide Openeye Name: 2-(4-ethylphenyl)-N-[2-(3-methoxy-4-pent-2-ynoxy-phenyl)ethyl]-2-prop-2-ynoxy-thioacetamide CAS Name: 2-(4-ethylphenyl)-N-[2-(3-methoxy-4-pent-2-ynoxyphenyl)ethyl]-2-prop-2-ynoxyethanethioamide IUPAC Name: 2-(4-ethylphenyl)-N-[2-(3-methoxy-4-pent-2-ynoxyphenyl)ethyl]-2-prop-2-ynoxyethanethioamide Traditional Name: 2-(4-ethylphenyl)-N-[2-(3-methoxy-4-pent-2-ynoxy-phenyl)ethyl]-2-propargyloxy-thioacetamide Formula: C27H31NO3S MolecularWeight: 449.60494

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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)CC)OCC#C)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H31NO3S/c1-5-8-9-19-30-24-15-12-22(20-25(24)29-4)16-17-28-27(32)26(31-18-6-2)23-13-10-21(7-3)11-14-23/h2,10-15,20,26H,5,7,16-19H2,1,3-4H3,(H,28,32)