4-[[4-(5-ethyl-4-methyl-thiophen-2-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(5-ethyl-4-methyl-thiophen-2-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(5-ethyl-4-methyl-thiophene-2-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(5-ethyl-4-methyl-2-thiophenyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(5-ethyl-4-methylthiophene-2-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(5-ethyl-4-methyl-thiophene-2-carbonyl)piperazino]methyl]benzonitrile Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C20H23N3OS/c1-3-18-15(2)12-19(25-18)20(24)23-10-8-22(9-11-23)14-17-6-4-16(13-21)5-7-17/h4-7,12H,3,8-11,14H2,1-2H3