N-[2-[[2-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[2-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[[2-[2-(4-bromophenoxy)ethyl-methyl-amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[[2-[2-(4-bromophenoxy)ethyl-methylamino]-2-oxoethyl]amino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[2-[2-(4-bromophenoxy)ethyl-methylamino]-2-oxoethyl]amino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[[2-[2-(4-bromophenoxy)ethyl-methyl-amino]-2-keto-ethyl]amino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C18H20BrN3O4S MolecularWeight: 454.3381

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Br)C(=O)CNC(=O)CNC(=O)C2=CC=CS2

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Br)C(=O)CNC(=O)CNC(=O)C2=CC=CS2

InChI

InChI=1S/C18H20BrN3O4S/c1-22(8-9-26-14-6-4-13(19)5-7-14)17(24)12-20-16(23)11-21-18(25)15-3-2-10-27-15/h2-7,10H,8-9,11-12H2,1H3,(H,20,23)(H,21,25)