N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]thiophene-2-carboxamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]thiophene-2-carboxamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]thiophene-2-carboxamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]thiophene-2-carboxamide Formula: C18H22N2O3S2 MolecularWeight: 378.50888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=CS2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=CS2)OC

InChI

InChI=1S/C18H22N2O3S2/c1-3-4-9-23-14-8-7-13(11-15(14)22-2)12-19-18(24)20-17(21)16-6-5-10-25-16/h5-8,10-11H,3-4,9,12H2,1-2H3,(H2,19,20,21,24)