S-(phenylmethyl) N-[4-methyl-1-oxidanylidene-1-(2-phenylhydrazinyl)pentan-2-yl]carbamothioate

Systemtic Name: S-(phenylmethyl) N-[4-methyl-1-oxidanylidene-1-(2-phenylhydrazinyl)pentan-2-yl]carbamothioate Openeye Name: S-benzyl N-[1-(anilinocarbamoyl)-3-methyl-butyl]carbamothioate CAS Name: N-[4-methyl-1-oxo-1-(phenylhydrazo)pentan-2-yl]carbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N-[4-methyl-1-oxo-1-(2-phenylhydrazinyl)pentan-2-yl]carbamothioate Traditional Name: N-[1-(anilinocarbamoyl)-3-methyl-butyl]thiocarbamic acid S-benzyl ester Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NNC1=CC=CC=C1)NC(=O)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)NNC1=CC=CC=C1)NC(=O)SCC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O2S/c1-15(2)13-18(19(24)23-22-17-11-7-4-8-12-17)21-20(25)26-14-16-9-5-3-6-10-16/h3-12,15,18,22H,13-14H2,1-2H3,(H,21,25)(H,23,24)