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

Systemtic Name: 1-[(2S,3S)-3-methyl-1-oxidanylidene-1-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]pentan-2-yl]urea Openeye Name: [(1S,2S)-1-[(benzylcarbamothioylamino)carbamoyl]-2-methyl-butyl]urea CAS Name: [(2S,3S)-3-methyl-1-oxo-1-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazo]pentan-2-yl]urea IUPAC Name: [(2S,3S)-1-[2-(benzylcarbamothioyl)hydrazinyl]-3-methyl-1-oxopentan-2-yl]urea Traditional Name: [(1S,2S)-1-[(benzylthiocarbamoylamino)carbamoyl]-2-methyl-butyl]urea Formula: C15H23N5O2S MolecularWeight: 337.44042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N5O2S/c1-3-10(2)12(18-14(16)22)13(21)19-20-15(23)17-9-11-7-5-4-6-8-11/h4-8,10,12H,3,9H2,1-2H3,(H,19,21)(H3,16,18,22)(H2,17,20,23)/t10-,12-/m0/s1