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

Systemtic Name: 2-ethyl-5-[(E)-1-(1-methyl-5-nitro-imidazol-2-yl)prop-1-en-2-yl]-1,3,4-thiadiazole Openeye Name: 2-ethyl-5-[(E)-1-methyl-2-(1-methyl-5-nitro-imidazol-2-yl)vinyl]-1,3,4-thiadiazole CAS Name: 2-ethyl-5-[(E)-1-(1-methyl-5-nitro-2-imidazolyl)prop-1-en-2-yl]-1,3,4-thiadiazole IUPAC Name: 2-ethyl-5-[(E)-1-(1-methyl-5-nitroimidazol-2-yl)prop-1-en-2-yl]-1,3,4-thiadiazole Traditional Name: 2-ethyl-5-[(E)-1-methyl-2-(1-methyl-5-nitro-imidazol-2-yl)vinyl]-1,3,4-thiadiazole Formula: C11H13N5O2S MolecularWeight: 279.31822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)C(=CC2=NC=C(N2C)[N+](=O)[O-])C

Isomeric SMILES

CCC1=NN=C(S1)/C(=C/C2=NC=C(N2C)[N+](=O)[O-])/C

InChI

InChI=1S/C11H13N5O2S/c1-4-9-13-14-11(19-9)7(2)5-8-12-6-10(15(8)3)16(17)18/h5-6H,4H2,1-3H3/b7-5+