1-(1,3-benzothiazol-2-yl)-3-[2-(3-fluoranylpyridin-2-yl)ethyl]thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3-fluoranylpyridin-2-yl)ethyl]thiourea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3-fluoro-2-pyridyl)ethyl]thiourea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3-fluoro-2-pyridinyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3-fluoropyridin-2-yl)ethyl]thiourea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3-fluoro-2-pyridyl)ethyl]thiourea Formula: C15H13FN4S2 MolecularWeight: 332.418923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=S)NCCC3=C(C=CC=N3)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=S)NCCC3=C(C=CC=N3)F

InChI

InChI=1S/C15H13FN4S2/c16-10-4-3-8-17-11(10)7-9-18-14(21)20-15-19-12-5-1-2-6-13(12)22-15/h1-6,8H,7,9H2,(H2,18,19,20,21)