2-[3-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]indol-1-yl]ethanenitrile

Systemtic Name: 2-[3-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]indol-1-yl]ethanenitrile Openeye Name: 2-[3-[(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]indol-1-yl]acetonitrile CAS Name: 2-[3-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-1-indolyl]acetonitrile IUPAC Name: 2-[3-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]indol-1-yl]acetonitrile Traditional Name: 2-[3-[(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]indol-1-yl]acetonitrile Formula: C14H10N4OS MolecularWeight: 282.3204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC#N)C=C3C(=O)NC(=S)N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC#N)C=C3C(=O)NC(=S)N3

InChI

InChI=1S/C14H10N4OS/c15-5-6-18-8-9(10-3-1-2-4-12(10)18)7-11-13(19)17-14(20)16-11/h1-4,7-8H,6H2,(H2,16,17,19,20)