N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]-2-hexoxybenzamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]-2-hexoxy-benzamide Formula: C26H36N2O4S MolecularWeight: 472.64004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NCC2=CC(=C(C=C2)OCCCC)OC

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NCC2=CC(=C(C=C2)OCCCC)OC

InChI

InChI=1S/C26H36N2O4S/c1-4-6-8-11-17-31-22-13-10-9-12-21(22)25(29)28-26(33)27-19-20-14-15-23(24(18-20)30-3)32-16-7-5-2/h9-10,12-15,18H,4-8,11,16-17,19H2,1-3H3,(H2,27,28,29,33)