1-ethyl-3-(7-ethynyl-1,3-benzothiazol-2-yl)urea

Systemtic Name: 1-ethyl-3-(7-ethynyl-1,3-benzothiazol-2-yl)urea Openeye Name: 1-ethyl-3-(7-ethynyl-1,3-benzothiazol-2-yl)urea CAS Name: 1-ethyl-3-(7-ethynyl-1,3-benzothiazol-2-yl)urea IUPAC Name: 1-ethyl-3-(7-ethynyl-1,3-benzothiazol-2-yl)urea Traditional Name: 1-ethyl-3-(7-ethynyl-1,3-benzothiazol-2-yl)urea Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=CC=CC(=C2S1)C#C

Isomeric SMILES

CCNC(=O)NC1=NC2=CC=CC(=C2S1)C#C

InChI

InChI=1S/C12H11N3OS/c1-3-8-6-5-7-9-10(8)17-12(14-9)15-11(16)13-4-2/h1,5-7H,4H2,2H3,(H2,13,14,15,16)