3-(3-cyanophenyl)-1-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-1-prop-2-enyl-urea

Systemtic Name: 3-(3-cyanophenyl)-1-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-1-prop-2-enyl-urea Openeye Name: 1-allyl-3-(3-cyanophenyl)-1-[(3-phenyl-4,5-dihydroisoxazol-5-yl)methyl]urea CAS Name: 3-(3-cyanophenyl)-1-[(3-phenyl-4,5-dihydroisoxazol-5-yl)methyl]-1-prop-2-enylurea IUPAC Name: 3-(3-cyanophenyl)-1-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-1-prop-2-enylurea Traditional Name: 1-allyl-3-(3-cyanophenyl)-1-[(3-phenyl-2-isoxazolin-5-yl)methyl]urea Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1CC(=NO1)C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C=CCN(CC1CC(=NO1)C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H20N4O2/c1-2-11-25(21(26)23-18-10-6-7-16(12-18)14-22)15-19-13-20(24-27-19)17-8-4-3-5-9-17/h2-10,12,19H,1,11,13,15H2,(H,23,26)