ethyl 3-azanyl-2-[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]-3-sulfanylidene-propanoate

Systemtic Name: ethyl 3-azanyl-2-[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]-3-sulfanylidene-propanoate Openeye Name: ethyl 3-amino-2-(5-benzyl-1,3,4-oxadiazol-2-yl)-3-thioxo-propanoate CAS Name: 3-amino-2-[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]-3-sulfanylidenepropanoic acid ethyl ester IUPAC Name: ethyl 3-amino-2-(5-benzyl-1,3,4-oxadiazol-2-yl)-3-sulfanylidenepropanoate Traditional Name: 3-amino-2-(5-benzyl-1,3,4-oxadiazol-2-yl)-3-thioxo-propionic acid ethyl ester Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=NN=C(O1)CC2=CC=CC=C2)C(=S)N

Isomeric SMILES

CCOC(=O)C(C1=NN=C(O1)CC2=CC=CC=C2)C(=S)N

InChI

InChI=1S/C14H15N3O3S/c1-2-19-14(18)11(12(15)21)13-17-16-10(20-13)8-9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3,(H2,15,21)