N-[4-[2-(1-benzofuran-2-yl)ethylcarbamothioylamino]phenyl]-2-methoxy-benzamide

Systemtic Name: N-[4-[2-(1-benzofuran-2-yl)ethylcarbamothioylamino]phenyl]-2-methoxy-benzamide Openeye Name: N-[4-[2-(benzofuran-2-yl)ethylcarbamothioylamino]phenyl]-2-methoxy-benzamide CAS Name: N-[4-[[[2-(2-benzofuranyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-2-methoxybenzamide IUPAC Name: N-[4-[2-(1-benzofuran-2-yl)ethylcarbamothioylamino]phenyl]-2-methoxybenzamide Traditional Name: N-[4-[2-(benzofuran-2-yl)ethylthiocarbamoylamino]phenyl]-2-methoxy-benzamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=S)NCCC3=CC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=S)NCCC3=CC4=CC=CC=C4O3

InChI

InChI=1S/C25H23N3O3S/c1-30-23-9-5-3-7-21(23)24(29)27-18-10-12-19(13-11-18)28-25(32)26-15-14-20-16-17-6-2-4-8-22(17)31-20/h2-13,16H,14-15H2,1H3,(H,27,29)(H2,26,28,32)