2-azanyl-4-(3,5-dimethylphenyl)-3-pyridin-2-yl-5-(1,2-thiazol-4-yl)benzamide

Systemtic Name: 2-azanyl-4-(3,5-dimethylphenyl)-3-pyridin-2-yl-5-(1,2-thiazol-4-yl)benzamide Openeye Name: 2-amino-4-(3,5-dimethylphenyl)-5-isothiazol-4-yl-3-(2-pyridyl)benzamide CAS Name: 2-amino-4-(3,5-dimethylphenyl)-5-(4-isothiazolyl)-3-(2-pyridinyl)benzamide IUPAC Name: 2-amino-4-(3,5-dimethylphenyl)-3-pyridin-2-yl-5-(1,2-thiazol-4-yl)benzamide Traditional Name: 2-amino-4-(3,5-dimethylphenyl)-5-isothiazol-4-yl-3-(2-pyridyl)benzamide Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C(=C(C=C2C3=CSN=C3)C(=O)N)N)C4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C(=C(C=C2C3=CSN=C3)C(=O)N)N)C4=CC=CC=N4)C

InChI

InChI=1S/C23H20N4OS/c1-13-7-14(2)9-15(8-13)20-17(16-11-27-29-12-16)10-18(23(25)28)22(24)21(20)19-5-3-4-6-26-19/h3-12H,24H2,1-2H3,(H2,25,28)