1-(6-bromanyl-1,3-benzothiazol-2-yl)-3-butyl-urea

Systemtic Name: 1-(6-bromanyl-1,3-benzothiazol-2-yl)-3-butyl-urea Openeye Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-3-butyl-urea CAS Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-3-butylurea IUPAC Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-3-butylurea Traditional Name: 1-(6-bromo-1,3-benzothiazol-2-yl)-3-butyl-urea Formula: C12H14BrN3OS MolecularWeight: 328.22806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=NC2=C(S1)C=C(C=C2)Br

Isomeric SMILES

CCCCNC(=O)NC1=NC2=C(S1)C=C(C=C2)Br

InChI

InChI=1S/C12H14BrN3OS/c1-2-3-6-14-11(17)16-12-15-9-5-4-8(13)7-10(9)18-12/h4-5,7H,2-3,6H2,1H3,(H2,14,15,16,17)