4-[[4-(4,5-dimethylthiophen-2-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(4,5-dimethylthiophen-2-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(4,5-dimethylthiophene-2-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(4,5-dimethyl-2-thiophenyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(4,5-dimethylthiophene-2-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(4,5-dimethylthiophene-2-carbonyl)piperazino]methyl]benzonitrile Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=C(SC(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C19H21N3OS/c1-14-11-18(24-15(14)2)19(23)22-9-7-21(8-10-22)13-17-5-3-16(12-20)4-6-17/h3-6,11H,7-10,13H2,1-2H3