N-[3-[(3-fluorophenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[3-[(3-fluorophenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[3-[(3-fluorophenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[3-[[(3-fluorophenyl)methylamino]-oxomethyl]phenyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[3-[(3-fluorophenyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[3-[(3-fluorobenzyl)carbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Formula: C22H16FN3O2S MolecularWeight: 405.444743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2)C(=O)NC3=CC=CC(=C3)C(=O)NCC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2)C(=O)NC3=CC=CC(=C3)C(=O)NCC4=CC(=CC=C4)F

InChI

InChI=1S/C22H16FN3O2S/c23-16-7-3-5-14(11-16)13-24-21(27)15-6-4-8-17(12-15)25-22(28)20-18-9-1-2-10-19(18)29-26-20/h1-12H,13H2,(H,24,27)(H,25,28)