1-[2-[2,5-dimethyl-1-(1-phenylethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[2-[2,5-dimethyl-1-(1-phenylethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[2-[2,5-dimethyl-1-(1-phenylethyl)pyrrol-3-yl]-2-oxo-ethyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[2-[2,5-dimethyl-1-(1-phenylethyl)-3-pyrrolyl]-2-oxoethyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[2-[2,5-dimethyl-1-(1-phenylethyl)pyrrol-3-yl]-2-oxoethyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[2-[2,5-dimethyl-1-(1-phenylethyl)pyrrol-3-yl]-2-keto-ethyl]-1,2,4-triazole-3-carbonitrile Formula: C19H19N5O MolecularWeight: 333.38706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C2=CC=CC=C2)C)C(=O)CN3C=NC(=N3)C#N

Isomeric SMILES

CC1=CC(=C(N1C(C)C2=CC=CC=C2)C)C(=O)CN3C=NC(=N3)C#N

InChI

InChI=1S/C19H19N5O/c1-13-9-17(18(25)11-23-12-21-19(10-20)22-23)15(3)24(13)14(2)16-7-5-4-6-8-16/h4-9,12,14H,11H2,1-3H3