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

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-4-phenyl-benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-4-phenyl-benzamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]-4-phenylbenzamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]-4-phenyl-benzamide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C26H28N2O3S/c1-3-4-16-31-23-15-10-19(17-24(23)30-2)18-27-26(32)28-25(29)22-13-11-21(12-14-22)20-8-6-5-7-9-20/h5-15,17H,3-4,16,18H2,1-2H3,(H2,27,28,29,32)