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

Systemtic Name: 2-(4-bromophenyl)-2-methoxy-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]ethanethioamide Openeye Name: 2-(4-bromophenyl)-2-methoxy-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]thioacetamide CAS Name: 2-(4-bromophenyl)-2-methoxy-N-[2-(3-methoxy-4-prop-2-ynoxyphenyl)ethyl]ethanethioamide IUPAC Name: 2-(4-bromophenyl)-2-methoxy-N-[2-(3-methoxy-4-prop-2-ynoxyphenyl)ethyl]ethanethioamide Traditional Name: 2-(4-bromophenyl)-2-methoxy-N-[2-(3-methoxy-4-propargyloxy-phenyl)ethyl]thioacetamide Formula: C21H22BrNO3S MolecularWeight: 448.37328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNC(=S)C(C2=CC=C(C=C2)Br)OC)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)CCNC(=S)C(C2=CC=C(C=C2)Br)OC)OCC#C

InChI

InChI=1S/C21H22BrNO3S/c1-4-13-26-18-10-5-15(14-19(18)24-2)11-12-23-21(27)20(25-3)16-6-8-17(22)9-7-16/h1,5-10,14,20H,11-13H2,2-3H3,(H,23,27)