N-[6-[(3,5-dimethylphenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[6-[(3,5-dimethylphenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(3,5-dimethylbenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(3,5-dimethylphenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(3,5-dimethylbenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(3,5-dimethylbenzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C21H17N3O3S MolecularWeight: 391.44298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)C

InChI

InChI=1S/C21H17N3O3S/c1-12-8-13(2)10-14(9-12)19(25)22-15-5-6-16-18(11-15)28-21(23-16)24-20(26)17-4-3-7-27-17/h3-11H,1-2H3,(H,22,25)(H,23,24,26)