3-[1-(4-chlorophenyl)butylsulfanyl]-5-(methylcarbamoylamino)-1,2-thiazole-4-carboxamide

Systemtic Name: 3-[1-(4-chlorophenyl)butylsulfanyl]-5-(methylcarbamoylamino)-1,2-thiazole-4-carboxamide Openeye Name: 3-[1-(4-chlorophenyl)butylsulfanyl]-5-(methylcarbamoylamino)isothiazole-4-carboxamide CAS Name: 3-[1-(4-chlorophenyl)butylthio]-5-(methylcarbamoylamino)-4-isothiazolecarboxamide IUPAC Name: 3-[1-(4-chlorophenyl)butylsulfanyl]-5-(methylcarbamoylamino)-1,2-thiazole-4-carboxamide Traditional Name: 3-[1-(4-chlorophenyl)butylthio]-5-(methylcarbamoylamino)isothiazole-4-carboxamide Formula: C16H19ClN4O2S2 MolecularWeight: 398.93066

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)Cl)SC2=NSC(=C2C(=O)N)NC(=O)NC

Isomeric SMILES

CCCC(C1=CC=C(C=C1)Cl)SC2=NSC(=C2C(=O)N)NC(=O)NC

InChI

InChI=1S/C16H19ClN4O2S2/c1-3-4-11(9-5-7-10(17)8-6-9)24-15-12(13(18)22)14(25-21-15)20-16(23)19-2/h5-8,11H,3-4H2,1-2H3,(H2,18,22)(H2,19,20,23)