3-[(4-chlorophenyl)methylsulfanyl]-5-(pyridin-4-ylamino)-1,2-thiazole-4-carboxamide

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(pyridin-4-ylamino)-1,2-thiazole-4-carboxamide Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(4-pyridylamino)isothiazole-4-carboxamide CAS Name: 3-[(4-chlorophenyl)methylthio]-5-(pyridin-4-ylamino)-4-isothiazolecarboxamide IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(pyridin-4-ylamino)-1,2-thiazole-4-carboxamide Traditional Name: 3-[(4-chlorobenzyl)thio]-5-(4-pyridylamino)isothiazole-4-carboxamide Formula: C16H13ClN4OS2 MolecularWeight: 376.88362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NSC(=C2C(=O)N)NC3=CC=NC=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=NSC(=C2C(=O)N)NC3=CC=NC=C3)Cl

InChI

InChI=1S/C16H13ClN4OS2/c17-11-3-1-10(2-4-11)9-23-16-13(14(18)22)15(24-21-16)20-12-5-7-19-8-6-12/h1-8H,9H2,(H2,18,22)(H,19,20)