2-[[1-phenyl-3-(phenylcarbamoylsulfanyl)propan-2-yl]carbamoylamino]ethanoic acid

Systemtic Name: 2-[[1-phenyl-3-(phenylcarbamoylsulfanyl)propan-2-yl]carbamoylamino]ethanoic acid Openeye Name: 2-[[1-benzyl-2-(phenylcarbamoylsulfanyl)ethyl]carbamoylamino]acetic acid CAS Name: 2-[[[[1-[[anilino(oxo)methyl]thio]-3-phenylpropan-2-yl]amino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-phenyl-3-(phenylcarbamoylsulfanyl)propan-2-yl]carbamoylamino]acetic acid Traditional Name: 2-[[1-benzyl-2-(phenylcarbamoylthio)ethyl]carbamoylamino]acetic acid Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CSC(=O)NC2=CC=CC=C2)NC(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CSC(=O)NC2=CC=CC=C2)NC(=O)NCC(=O)O

InChI

InChI=1S/C19H21N3O4S/c23-17(24)12-20-18(25)21-16(11-14-7-3-1-4-8-14)13-27-19(26)22-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,22,26)(H,23,24)(H2,20,21,25)