2-ethyl-5-[(E)-1-(1-ethyl-5-nitro-imidazol-2-yl)prop-1-en-2-yl]-1,3,4-thiadiazole

Systemtic Name: 2-ethyl-5-[(E)-1-(1-ethyl-5-nitro-imidazol-2-yl)prop-1-en-2-yl]-1,3,4-thiadiazole Openeye Name: 2-ethyl-5-[(E)-2-(1-ethyl-5-nitro-imidazol-2-yl)-1-methyl-vinyl]-1,3,4-thiadiazole CAS Name: 2-ethyl-5-[(E)-1-(1-ethyl-5-nitro-2-imidazolyl)prop-1-en-2-yl]-1,3,4-thiadiazole IUPAC Name: 2-ethyl-5-[(E)-1-(1-ethyl-5-nitroimidazol-2-yl)prop-1-en-2-yl]-1,3,4-thiadiazole Traditional Name: 2-ethyl-5-[(E)-2-(1-ethyl-5-nitro-imidazol-2-yl)-1-methyl-vinyl]-1,3,4-thiadiazole Formula: C12H15N5O2S MolecularWeight: 293.3448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)C(=CC2=NC=C(N2CC)[N+](=O)[O-])C

Isomeric SMILES

CCC1=NN=C(S1)/C(=C/C2=NC=C(N2CC)[N+](=O)[O-])/C

InChI

InChI=1S/C12H15N5O2S/c1-4-10-14-15-12(20-10)8(3)6-9-13-7-11(17(18)19)16(9)5-2/h6-7H,4-5H2,1-3H3/b8-6+