N-(1,3-benzothiazol-2-ylmethyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinamide Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H18N4O2S2/c1-12-15(13(2)26-24-12)11-27-20-14(6-5-9-21-20)19(25)22-10-18-23-16-7-3-4-8-17(16)28-18/h3-9H,10-11H2,1-2H3,(H,22,25)