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

Systemtic Name: N-(cyclopropylmethyl)-5-[[(4-methylphenyl)carbonyl-prop-2-enyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[[allyl-(4-methylbenzoyl)amino]methyl]-N-(cyclopropylmethyl)isoxazole-3-carboxamide CAS Name: N-(cyclopropylmethyl)-5-[[[(4-methylphenyl)-oxomethyl]-prop-2-enylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(cyclopropylmethyl)-5-[[(4-methylbenzoyl)-prop-2-enylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[allyl(p-toluoyl)amino]methyl]-N-(cyclopropylmethyl)isoxazole-3-carboxamide Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC(=NO2)C(=O)NCC3CC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC(=NO2)C(=O)NCC3CC3

InChI

InChI=1S/C20H23N3O3/c1-3-10-23(20(25)16-8-4-14(2)5-9-16)13-17-11-18(22-26-17)19(24)21-12-15-6-7-15/h3-5,8-9,11,15H,1,6-7,10,12-13H2,2H3,(H,21,24)