N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-(4-methylphenyl)-1,2-oxazole-5-carboxamide

Systemtic Name: N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-(4-methylphenyl)-1,2-oxazole-5-carboxamide Openeye Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-(p-tolyl)isoxazole-5-carboxamide CAS Name: N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-3-(4-methylphenyl)-5-isoxazolecarboxamide IUPAC Name: N-[2-(diethylamino)-2-thiophen-3-ylethyl]-3-(4-methylphenyl)-1,2-oxazole-5-carboxamide Traditional Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-(p-tolyl)isoxazole-5-carboxamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CC(=NO1)C2=CC=C(C=C2)C)C3=CSC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CC(=NO1)C2=CC=C(C=C2)C)C3=CSC=C3

InChI

InChI=1S/C21H25N3O2S/c1-4-24(5-2)19(17-10-11-27-14-17)13-22-21(25)20-12-18(23-26-20)16-8-6-15(3)7-9-16/h6-12,14,19H,4-5,13H2,1-3H3,(H,22,25)