2-(4-phenylpiperazin-1-yl)carbonyl-3-(1,2,5-trimethylpyrrol-3-yl)prop-2-enenitrile

Systemtic Name: 2-(4-phenylpiperazin-1-yl)carbonyl-3-(1,2,5-trimethylpyrrol-3-yl)prop-2-enenitrile Openeye Name: 2-(4-phenylpiperazine-1-carbonyl)-3-(1,2,5-trimethylpyrrol-3-yl)prop-2-enenitrile CAS Name: 2-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-(1,2,5-trimethyl-3-pyrrolyl)-2-propenenitrile IUPAC Name: 2-(4-phenylpiperazine-1-carbonyl)-3-(1,2,5-trimethylpyrrol-3-yl)prop-2-enenitrile Traditional Name: 2-(4-phenylpiperazine-1-carbonyl)-3-(1,2,5-trimethylpyrrol-3-yl)acrylonitrile Formula: C21H24N4O MolecularWeight: 348.44146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C=C(C#N)C(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C)C)C=C(C#N)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O/c1-16-13-18(17(2)23(16)3)14-19(15-22)21(26)25-11-9-24(10-12-25)20-7-5-4-6-8-20/h4-8,13-14H,9-12H2,1-3H3