(5Z)-5-[(3E)-3-imidazol-4-ylidene-1-thiophen-2-yl-butan-2-ylidene]-1,2-dihydro-1,2,3,4-tetrazole

Systemtic Name: (5Z)-5-[(3E)-3-imidazol-4-ylidene-1-thiophen-2-yl-butan-2-ylidene]-1,2-dihydro-1,2,3,4-tetrazole Openeye Name: (5Z)-5-[(2E)-2-imidazol-4-ylidene-1-(2-thienylmethyl)propylidene]-1,2-dihydrotetrazole CAS Name: (5Z)-5-[(3E)-3-(4-imidazolylidene)-1-thiophen-2-ylbutan-2-ylidene]-1,2-dihydrotetrazole IUPAC Name: (5Z)-5-[(3E)-3-imidazol-4-ylidene-1-thiophen-2-ylbutan-2-ylidene]-1,2-dihydrotetrazole Traditional Name: (5Z)-5-[(2E)-2-imidazol-4-ylidene-1-(2-thenyl)propylidene]-1,2-dihydrotetrazole Formula: C12H12N6S MolecularWeight: 272.32888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=NC=N1)C(=C2NNN=N2)CC3=CC=CS3

Isomeric SMILES

C/C(=C\1/C=NC=N1)/C(=C\2/NNN=N2)/CC3=CC=CS3

InChI

InChI=1S/C12H12N6S/c1-8(11-6-13-7-14-11)10(12-15-17-18-16-12)5-9-3-2-4-19-9/h2-4,6-7H,5H2,1H3,(H,15,18)(H,16,17)/b11-8+