2-[2-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-(5-benzyl-6-thioxo-1,3,5-thiadiazinan-3-yl)acetyl]amino]acetic acid CAS Name: 2-[[1-oxo-2-[5-(phenylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]ethyl]amino]acetic acid IUPAC Name: 2-[[2-(5-benzyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)acetyl]amino]acetic acid Traditional Name: 2-[[2-(5-benzyl-6-thioxo-1,3,5-thiadiazinan-3-yl)acetyl]amino]acetic acid Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1CC2=CC=CC=C2)CC(=O)NCC(=O)O

Isomeric SMILES

C1N(CSC(=S)N1CC2=CC=CC=C2)CC(=O)NCC(=O)O

InChI

InChI=1S/C14H17N3O3S2/c18-12(15-6-13(19)20)8-16-9-17(14(21)22-10-16)7-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,15,18)(H,19,20)