1-[3,5-bis(bromanyl)-2-(dimethylamino)-6-oxidanyl-phenyl]-3-pentyl-urea

Systemtic Name: 1-[3,5-bis(bromanyl)-2-(dimethylamino)-6-oxidanyl-phenyl]-3-pentyl-urea Openeye Name: 1-[3,5-dibromo-2-(dimethylamino)-6-hydroxy-phenyl]-3-pentyl-urea CAS Name: 1-[3,5-dibromo-2-(dimethylamino)-6-hydroxyphenyl]-3-pentylurea IUPAC Name: 1-[3,5-dibromo-2-(dimethylamino)-6-hydroxyphenyl]-3-pentylurea Traditional Name: 1-amyl-3-[3,5-dibromo-2-(dimethylamino)-6-hydroxy-phenyl]urea Formula: C14H21Br2N3O2 MolecularWeight: 423.14344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1=C(C(=CC(=C1O)Br)Br)N(C)C

Isomeric SMILES

CCCCCNC(=O)NC1=C(C(=CC(=C1O)Br)Br)N(C)C

InChI

InChI=1S/C14H21Br2N3O2/c1-4-5-6-7-17-14(21)18-11-12(19(2)3)9(15)8-10(16)13(11)20/h8,20H,4-7H2,1-3H3,(H2,17,18,21)