N-(3,4-dimethylphenyl)-2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-2-[[4-(3-thienylmethyl)piperazin-1-yl]methyl]oxazole-4-carboxamide CAS Name: N-(3,4-dimethylphenyl)-2-[[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]-4-oxazolecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-2-[[4-(3-thenyl)piperazino]methyl]oxazole-4-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=COC(=N2)CN3CCN(CC3)CC4=CSC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=COC(=N2)CN3CCN(CC3)CC4=CSC=C4)C

InChI

InChI=1S/C22H26N4O2S/c1-16-3-4-19(11-17(16)2)23-22(27)20-14-28-21(24-20)13-26-8-6-25(7-9-26)12-18-5-10-29-15-18/h3-5,10-11,14-15H,6-9,12-13H2,1-2H3,(H,23,27)