1-[5-(phenethylamino)-1,2,4-thiadiazol-3-yl]propan-2-one

Systemtic Name: 1-[5-(phenethylamino)-1,2,4-thiadiazol-3-yl]propan-2-one Openeye Name: 1-[5-(phenethylamino)-1,2,4-thiadiazol-3-yl]propan-2-one CAS Name: 1-[5-(phenethylamino)-1,2,4-thiadiazol-3-yl]-2-propanone IUPAC Name: 1-[5-(phenethylamino)-1,2,4-thiadiazol-3-yl]propan-2-one Traditional Name: 1-[5-(phenethylamino)-1,2,4-thiadiazol-3-yl]acetone Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=NSC(=N1)NCCC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC1=NSC(=N1)NCCC2=CC=CC=C2

InChI

InChI=1S/C13H15N3OS/c1-10(17)9-12-15-13(18-16-12)14-8-7-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3,(H,14,15,16)