1-[(2S)-2-azanyl-5-methyl-2H-1,3,4-thiadiazol-3-yl]-3-(1,3-benzoxazol-2-ylsulfanyl)propan-2-one

Systemtic Name: 1-[(2S)-2-azanyl-5-methyl-2H-1,3,4-thiadiazol-3-yl]-3-(1,3-benzoxazol-2-ylsulfanyl)propan-2-one Openeye Name: 1-[(2S)-2-amino-5-methyl-2H-1,3,4-thiadiazol-3-yl]-3-(1,3-benzoxazol-2-ylsulfanyl)propan-2-one CAS Name: 1-[(2S)-2-amino-5-methyl-2H-1,3,4-thiadiazol-3-yl]-3-(1,3-benzoxazol-2-ylthio)-2-propanone IUPAC Name: 1-[(2S)-2-amino-5-methyl-2H-1,3,4-thiadiazol-3-yl]-3-(1,3-benzoxazol-2-ylsulfanyl)propan-2-one Traditional Name: 1-[(2S)-2-amino-5-methyl-2H-1,3,4-thiadiazol-3-yl]-3-(1,3-benzoxazol-2-ylthio)acetone Formula: C13H14N4O2S2 MolecularWeight: 322.40586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(S1)N)CC(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=NN([C@@H](S1)N)CC(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C13H14N4O2S2/c1-8-16-17(12(14)21-8)6-9(18)7-20-13-15-10-4-2-3-5-11(10)19-13/h2-5,12H,6-7,14H2,1H3/t12-/m0/s1