bromanylmethane; N-(2-diethylaminoethyl)-3,5,7-trimethoxy-1-benzothiophene-2-carboxamide

Systemtic Name: bromanylmethane; N-(2-diethylaminoethyl)-3,5,7-trimethoxy-1-benzothiophene-2-carboxamide Openeye Name: bromomethane; N-(2-diethylaminoethyl)-3,5,7-trimethoxy-benzothiophene-2-carboxamide CAS Name: bromomethane; N-(2-diethylaminoethyl)-3,5,7-trimethoxy-1-benzothiophene-2-carboxamide IUPAC Name: bromomethane; N-(2-diethylaminoethyl)-3,5,7-trimethoxy-1-benzothiophene-2-carboxamide Traditional Name: bromomethane; N-(2-diethylaminoethyl)-3,5,7-trimethoxy-benzothiophene-2-carboxamide Formula: C19H29BrN2O4S MolecularWeight: 461.41356

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C2=CC(=CC(=C2S1)OC)OC)OC.CBr

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C2=CC(=CC(=C2S1)OC)OC)OC.CBr

InChI

InChI=1S/C18H26N2O4S.CH3Br/c1-6-20(7-2)9-8-19-18(21)17-15(24-5)13-10-12(22-3)11-14(23-4)16(13)25-17;1-2/h10-11H,6-9H2,1-5H3,(H,19,21);1H3