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

Systemtic Name: 4-[2-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 4-[2-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-1,2,4-triazole-3-carbonitrile CAS Name: 4-[2-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-oxoethyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 4-[2-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-oxoethyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 4-[2-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]-1,2,4-triazole-3-carbonitrile Formula: C14H17N5O MolecularWeight: 271.31768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)CN2C=NN=C2C#N

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)CN2C=NN=C2C#N

InChI

InChI=1S/C14H17N5O/c1-9(2)19-10(3)5-12(11(19)4)13(20)7-18-8-16-17-14(18)6-15/h5,8-9H,7H2,1-4H3