prop-2-enyl 2-(ethoxycarbonylcarbamothioylamino)-2-naphthalen-1-yl-ethanoate

Systemtic Name: prop-2-enyl 2-(ethoxycarbonylcarbamothioylamino)-2-naphthalen-1-yl-ethanoate Openeye Name: allyl 2-(ethoxycarbonylcarbamothioylamino)-2-(1-naphthyl)acetate CAS Name: 2-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-2-(1-naphthalenyl)acetic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-(ethoxycarbonylcarbamothioylamino)-2-naphthalen-1-ylacetate Traditional Name: 2-(carbethoxythiocarbamoylamino)-2-(1-naphthyl)acetic acid allyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC(C1=CC=CC2=CC=CC=C21)C(=O)OCC=C

Isomeric SMILES

CCOC(=O)NC(=S)NC(C1=CC=CC2=CC=CC=C21)C(=O)OCC=C

InChI

InChI=1S/C19H20N2O4S/c1-3-12-25-17(22)16(20-18(26)21-19(23)24-4-2)15-11-7-9-13-8-5-6-10-14(13)15/h3,5-11,16H,1,4,12H2,2H3,(H2,20,21,23,26)