N-(cyanomethyl)-3-naphthalen-2-yl-2-(phenylcarbamothioylamino)propanamide

Systemtic Name: N-(cyanomethyl)-3-naphthalen-2-yl-2-(phenylcarbamothioylamino)propanamide Openeye Name: N-(cyanomethyl)-3-(2-naphthyl)-2-(phenylcarbamothioylamino)propanamide CAS Name: 2-[[anilino(sulfanylidene)methyl]amino]-N-(cyanomethyl)-3-(2-naphthalenyl)propanamide IUPAC Name: N-(cyanomethyl)-3-naphthalen-2-yl-2-(phenylcarbamothioylamino)propanamide Traditional Name: N-(cyanomethyl)-3-(2-naphthyl)-2-(phenylthiocarbamoylamino)propionamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC#N

InChI

InChI=1S/C22H20N4OS/c23-12-13-24-21(27)20(26-22(28)25-19-8-2-1-3-9-19)15-16-10-11-17-6-4-5-7-18(17)14-16/h1-11,14,20H,13,15H2,(H,24,27)(H2,25,26,28)