(E)-3-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazol-4-yl]-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-2-[oxo(1-pyrrolidinyl)methyl]-2-propenenitrile IUPAC Name: (E)-3-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazol-4-yl]-2-(pyrrolidine-1-carbonyl)acrylonitrile Formula: C20H21ClN4O MolecularWeight: 368.85994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=C(C#N)C(=O)N3CCCC3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=C(\C#N)/C(=O)N3CCCC3)Cl

InChI

InChI=1S/C20H21ClN4O/c1-14-5-7-16(8-6-14)13-25-19(21)18(15(2)23-25)11-17(12-22)20(26)24-9-3-4-10-24/h5-8,11H,3-4,9-10,13H2,1-2H3/b17-11+