2-(2-chloranylphenoxy)-N-[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]phenyl]propanamide

Systemtic Name: 2-(2-chloranylphenoxy)-N-[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]phenyl]propanamide Openeye Name: 2-(2-chlorophenoxy)-N-[4-[[(E)-3-(1-naphthyl)prop-2-enoyl]carbamothioylamino]phenyl]propanamide CAS Name: 2-(2-chlorophenoxy)-N-[4-[[[[(E)-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: 2-(2-chlorophenoxy)-N-[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]phenyl]propanamide Traditional Name: 2-(2-chlorophenoxy)-N-[4-[[(E)-3-(1-naphthyl)acryloyl]thiocarbamoylamino]phenyl]propionamide Formula: C29H24ClN3O3S MolecularWeight: 530.03716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CC3=CC=CC=C32)OC4=CC=CC=C4Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=CC3=CC=CC=C32)OC4=CC=CC=C4Cl

InChI

InChI=1S/C29H24ClN3O3S/c1-19(36-26-12-5-4-11-25(26)30)28(35)31-22-14-16-23(17-15-22)32-29(37)33-27(34)18-13-21-9-6-8-20-7-2-3-10-24(20)21/h2-19H,1H3,(H,31,35)(H2,32,33,34,37)/b18-13+