1-[(E)-4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]but-3-en-2-yl]-1-oxidanyl-urea

Systemtic Name: 1-[(E)-4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]but-3-en-2-yl]-1-oxidanyl-urea Openeye Name: 1-[(E)-3-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-1-methyl-allyl]-1-hydroxy-urea CAS Name: 1-[(E)-4-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]but-3-en-2-yl]-1-hydroxyurea IUPAC Name: 1-[(E)-4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]but-3-en-2-yl]-1-hydroxyurea Traditional Name: 1-[(E)-3-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-1-methyl-allyl]-1-hydroxy-urea Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C=CC(C)N(C(=O)N)O)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)/C=C/C(C)N(C(=O)N)O)C

InChI

InChI=1S/C17H21N3O2/c1-12-4-5-13(2)19(12)16-10-8-15(9-11-16)7-6-14(3)20(22)17(18)21/h4-11,14,22H,1-3H3,(H2,18,21)/b7-6+