4-methyl-N-(phenylmethyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]pentanamide

Systemtic Name: 4-methyl-N-(phenylmethyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]pentanamide Openeye Name: N-benzyl-4-methyl-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]pentanamide CAS Name: 4-methyl-2-[[oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl]amino]-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-4-methyl-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]pentanamide Traditional Name: N-benzyl-4-methyl-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]valeramide Formula: C16H21N5O2S2 MolecularWeight: 379.50024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC1=CC=CC=C1)NC(=O)NC2=NNC(=S)S2

Isomeric SMILES

CC(C)CC(C(=O)NCC1=CC=CC=C1)NC(=O)NC2=NNC(=S)S2

InChI

InChI=1S/C16H21N5O2S2/c1-10(2)8-12(13(22)17-9-11-6-4-3-5-7-11)18-14(23)19-15-20-21-16(24)25-15/h3-7,10,12H,8-9H2,1-2H3,(H,17,22)(H,21,24)(H2,18,19,20,23)