methyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)amino]-3-phenyl-propanoate Openeye Name: methyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-phenyl-propanoate CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-phenylpropanoate Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)amino]-3-phenyl-propionic acid methyl ester Formula: C12H14N4O2S MolecularWeight: 278.33016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC2=NN=C(S2)N

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC2=NN=C(S2)N

InChI

InChI=1S/C12H14N4O2S/c1-18-10(17)9(7-8-5-3-2-4-6-8)14-12-16-15-11(13)19-12/h2-6,9H,7H2,1H3,(H2,13,15)(H,14,16)