N-[(2S,3S)-3-methyl-1-oxidanylidene-1-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]pentan-2-yl]benzamide

Systemtic Name: N-[(2S,3S)-3-methyl-1-oxidanylidene-1-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]pentan-2-yl]benzamide Openeye Name: N-[(1S,2S)-1-[(benzylcarbamothioylamino)carbamoyl]-2-methyl-butyl]benzamide CAS Name: N-[(2S,3S)-3-methyl-1-oxo-1-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazo]pentan-2-yl]benzamide IUPAC Name: N-[(2S,3S)-1-[2-(benzylcarbamothioyl)hydrazinyl]-3-methyl-1-oxopentan-2-yl]benzamide Traditional Name: N-[(1S,2S)-1-[(benzylthiocarbamoylamino)carbamoyl]-2-methyl-butyl]benzamide Formula: C21H26N4O2S MolecularWeight: 398.52174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NNC(=S)NCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NNC(=S)NCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H26N4O2S/c1-3-15(2)18(23-19(26)17-12-8-5-9-13-17)20(27)24-25-21(28)22-14-16-10-6-4-7-11-16/h4-13,15,18H,3,14H2,1-2H3,(H,23,26)(H,24,27)(H2,22,25,28)/t15-,18-/m0/s1