5-[[(4-tert-butylphenyl)carbonyl-prop-2-enyl-amino]methyl]-N-[(4-methylphenyl)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[[(4-tert-butylphenyl)carbonyl-prop-2-enyl-amino]methyl]-N-[(4-methylphenyl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[[allyl-(4-tert-butylbenzoyl)amino]methyl]-N-(p-tolylmethyl)isoxazole-3-carboxamide CAS Name: 5-[[[(4-tert-butylphenyl)-oxomethyl]-prop-2-enylamino]methyl]-N-[(4-methylphenyl)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[[(4-tert-butylbenzoyl)-prop-2-enylamino]methyl]-N-[(4-methylphenyl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[allyl-(4-tert-butylbenzoyl)amino]methyl]-N-(4-methylbenzyl)isoxazole-3-carboxamide Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC=C)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC=C)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H31N3O3/c1-6-15-30(26(32)21-11-13-22(14-12-21)27(3,4)5)18-23-16-24(29-33-23)25(31)28-17-20-9-7-19(2)8-10-20/h6-14,16H,1,15,17-18H2,2-5H3,(H,28,31)