3-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-N-[N'-(2-diethylaminoethyl)carbamimidoyl]thiophene-2-carboxamide

Systemtic Name: 3-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-N-[N'-(2-diethylaminoethyl)carbamimidoyl]thiophene-2-carboxamide Openeye Name: 3-[2-(5-bromo-2-methoxy-phenyl)ethyl]-N-[N'-(2-diethylaminoethyl)carbamimidoyl]thiophene-2-carboxamide CAS Name: N-[amino(2-diethylaminoethylimino)methyl]-3-[2-(5-bromo-2-methoxyphenyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 3-[2-(5-bromo-2-methoxyphenyl)ethyl]-N-[N'-(2-diethylaminoethyl)carbamimidoyl]thiophene-2-carboxamide Traditional Name: 3-[2-(5-bromo-2-methoxy-phenyl)ethyl]-N-[N'-(2-diethylaminoethyl)amidino]thiophene-2-carboxamide Formula: C21H29BrN4O2S MolecularWeight: 481.44956

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN=C(N)NC(=O)C1=C(C=CS1)CCC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CCN(CC)CCN=C(N)NC(=O)C1=C(C=CS1)CCC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C21H29BrN4O2S/c1-4-26(5-2)12-11-24-21(23)25-20(27)19-15(10-13-29-19)6-7-16-14-17(22)8-9-18(16)28-3/h8-10,13-14H,4-7,11-12H2,1-3H3,(H3,23,24,25,27)