1-ethyl-3-(5-pyrazol-1-yl-7-pyridin-3-yl-1,3-benzothiazol-2-yl)urea

Systemtic Name: 1-ethyl-3-(5-pyrazol-1-yl-7-pyridin-3-yl-1,3-benzothiazol-2-yl)urea Openeye Name: 1-ethyl-3-[5-pyrazol-1-yl-7-(3-pyridyl)-1,3-benzothiazol-2-yl]urea CAS Name: 1-ethyl-3-[5-(1-pyrazolyl)-7-(3-pyridinyl)-1,3-benzothiazol-2-yl]urea IUPAC Name: 1-ethyl-3-(5-pyrazol-1-yl-7-pyridin-3-yl-1,3-benzothiazol-2-yl)urea Traditional Name: 1-ethyl-3-[5-pyrazol-1-yl-7-(3-pyridyl)-1,3-benzothiazol-2-yl]urea Formula: C18H16N6OS MolecularWeight: 364.42424

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(S1)C(=CC(=C2)N3C=CC=N3)C4=CN=CC=C4

Isomeric SMILES

CCNC(=O)NC1=NC2=C(S1)C(=CC(=C2)N3C=CC=N3)C4=CN=CC=C4

InChI

InChI=1S/C18H16N6OS/c1-2-20-17(25)23-18-22-15-10-13(24-8-4-7-21-24)9-14(16(15)26-18)12-5-3-6-19-11-12/h3-11H,2H2,1H3,(H2,20,22,23,25)