N-[(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)carbamothioyl]benzamide

Systemtic Name: N-[(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)carbamothioyl]benzamide Openeye Name: N-[(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)carbamothioyl]benzamide CAS Name: N-[[(2-cyano-1-spiro[4H-naphthalene-3,1'-cyclopentane]yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)carbamothioyl]benzamide Traditional Name: N-[(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)thiocarbamoyl]benzamide Formula: C23H21N3OS MolecularWeight: 387.49734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC3=CC=CC=C3C(=C2C#N)NC(=S)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC2(C1)CC3=CC=CC=C3C(=C2C#N)NC(=S)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3OS/c24-15-19-20(25-22(28)26-21(27)16-8-2-1-3-9-16)18-11-5-4-10-17(18)14-23(19)12-6-7-13-23/h1-5,8-11H,6-7,12-14H2,(H2,25,26,27,28)