N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]butan-2-yl]benzamide

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]butan-2-yl]benzamide Openeye Name: N-[(1S)-1-[(benzylcarbamothioylamino)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazo]butan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[2-(benzylcarbamothioyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1S)-1-[(benzylthiocarbamoylamino)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O2S2/c1-28-13-12-17(22-18(25)16-10-6-3-7-11-16)19(26)23-24-20(27)21-14-15-8-4-2-5-9-15/h2-11,17H,12-14H2,1H3,(H,22,25)(H,23,26)(H2,21,24,27)/t17-/m0/s1