4-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-[2,5-dimethyl-1-(2-thiazolyl)-3-pyrrolyl]-2-oxoethoxy]benzonitrile IUPAC Name: 4-[2-[2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrol-3-yl]-2-oxoethoxy]benzonitrile Traditional Name: 4-[2-(2,5-dimethyl-1-thiazol-2-yl-pyrrol-3-yl)-2-keto-ethoxy]benzonitrile Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H15N3O2S/c1-12-9-16(13(2)21(12)18-20-7-8-24-18)17(22)11-23-15-5-3-14(10-19)4-6-15/h3-9H,11H2,1-2H3