N-[4-[(5-methylfuran-2-yl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[4-[(5-methylfuran-2-yl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[4-[(5-methyl-2-furyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[4-[[(5-methyl-2-furanyl)methylamino]-oxomethyl]phenyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[4-[(5-methylfuran-2-yl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[4-[(5-methyl-2-furyl)methylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O3S/c1-13-6-11-16(27-13)12-22-20(25)14-7-9-15(10-8-14)23-21(26)19-17-4-2-3-5-18(17)28-24-19/h2-11H,12H2,1H3,(H,22,25)(H,23,26)