(phenylmethyl) N-[(2S)-1-oxidanylidene-3-phenyl-1-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-oxidanylidene-3-phenyl-1-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-benzyl-2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-oxo-3-phenyl-1-[[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]amino]propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-[[5-(benzylthio)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]carbamic acid benzyl ester Formula: C26H24N4O3S2 MolecularWeight: 504.62376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H24N4O3S2/c31-23(28-24-29-30-26(35-24)34-18-21-14-8-3-9-15-21)22(16-19-10-4-1-5-11-19)27-25(32)33-17-20-12-6-2-7-13-20/h1-15,22H,16-18H2,(H,27,32)(H,28,29,31)/t22-/m0/s1