2-[4-[[5-azanylidene-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-oxidanylidene-thiolan-2-ylidene]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[5-azanylidene-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-oxidanylidene-thiolan-2-ylidene]methyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-oxo-tetrahydrothiophen-2-ylidene]methyl]phenoxy]acetonitrile CAS Name: 2-[4-[[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-oxo-2-thiolanylidene]methyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-oxothiolan-2-ylidene]methyl]phenoxy]acetonitrile Traditional Name: 2-[4-[[4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-keto-tetrahydrothiophen-2-ylidene]methyl]phenoxy]acetonitrile Formula: C17H14N4O2S2 MolecularWeight: 370.44866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)C2C(=O)C(=CC3=CC=C(C=C3)OCC#N)SC2=N

Isomeric SMILES

CCC1=NN=C(S1)C2C(=O)C(=CC3=CC=C(C=C3)OCC#N)SC2=N

InChI

InChI=1S/C17H14N4O2S2/c1-2-13-20-21-17(25-13)14-15(22)12(24-16(14)19)9-10-3-5-11(6-4-10)23-8-7-18/h3-6,9,14,19H,2,8H2,1H3