N-[2-(1,2-benzothiazol-3-ylamino)ethyl]-5-fluoranyl-1H-indole-2-carboxamide

Systemtic Name: N-[2-(1,2-benzothiazol-3-ylamino)ethyl]-5-fluoranyl-1H-indole-2-carboxamide Openeye Name: N-[2-(1,2-benzothiazol-3-ylamino)ethyl]-5-fluoro-1H-indole-2-carboxamide CAS Name: N-[2-(1,2-benzothiazol-3-ylamino)ethyl]-5-fluoro-1H-indole-2-carboxamide IUPAC Name: N-[2-(1,2-benzothiazol-3-ylamino)ethyl]-5-fluoro-1H-indole-2-carboxamide Traditional Name: N-[2-(1,2-benzothiazol-3-ylamino)ethyl]-5-fluoro-1H-indole-2-carboxamide Formula: C18H15FN4OS MolecularWeight: 354.401303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2)NCCNC(=O)C3=CC4=C(N3)C=CC(=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2)NCCNC(=O)C3=CC4=C(N3)C=CC(=C4)F

InChI

InChI=1S/C18H15FN4OS/c19-12-5-6-14-11(9-12)10-15(22-14)18(24)21-8-7-20-17-13-3-1-2-4-16(13)25-23-17/h1-6,9-10,22H,7-8H2,(H,20,23)(H,21,24)