N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-phenyl-2-[4-(3-thienylmethyl)piperazin-1-yl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-phenyl-2-[4-(3-thiophenylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-phenyl-2-[4-(3-thenyl)piperazino]acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C21H24N4O2S/c1-16-13-19(23-27-16)22-21(26)20(18-5-3-2-4-6-18)25-10-8-24(9-11-25)14-17-7-12-28-15-17/h2-7,12-13,15,20H,8-11,14H2,1H3,(H,22,23,26)