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

Systemtic Name: 2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-N-(N'-butylcarbamimidoyl)thiophene-3-carboxamide Openeye Name: 2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-N-(N'-butylcarbamimidoyl)thiophene-3-carboxamide CAS Name: N-[amino(butylimino)methyl]-2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-thiophenecarboxamide IUPAC Name: 2-[2-(5-bromo-2-methoxyphenyl)ethyl]-N-(N'-butylcarbamimidoyl)thiophene-3-carboxamide Traditional Name: 2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-N-(N'-butylamidino)thiophene-3-carboxamide Formula: C19H24BrN3O2S MolecularWeight: 438.38176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(N)NC(=O)C1=C(SC=C1)CCC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CCCCN=C(N)NC(=O)C1=C(SC=C1)CCC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C19H24BrN3O2S/c1-3-4-10-22-19(21)23-18(24)15-9-11-26-17(15)8-5-13-12-14(20)6-7-16(13)25-2/h6-7,9,11-12H,3-5,8,10H2,1-2H3,(H3,21,22,23,24)