5-(butylcarbamoylamino)-3-methyl-N-(4-methylsulfanylphenyl)-1,2-thiazole-4-carboxamide

Systemtic Name: 5-(butylcarbamoylamino)-3-methyl-N-(4-methylsulfanylphenyl)-1,2-thiazole-4-carboxamide Openeye Name: 5-(butylcarbamoylamino)-3-methyl-N-(4-methylsulfanylphenyl)isothiazole-4-carboxamide CAS Name: 5-[[butylamino(oxo)methyl]amino]-3-methyl-N-[4-(methylthio)phenyl]-4-isothiazolecarboxamide IUPAC Name: 5-(butylcarbamoylamino)-3-methyl-N-(4-methylsulfanylphenyl)-1,2-thiazole-4-carboxamide Traditional Name: 5-(butylcarbamoylamino)-3-methyl-N-[4-(methylthio)phenyl]isothiazole-4-carboxamide Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C(C(=NS1)C)C(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

CCCCNC(=O)NC1=C(C(=NS1)C)C(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C17H22N4O2S2/c1-4-5-10-18-17(23)20-16-14(11(2)21-25-16)15(22)19-12-6-8-13(24-3)9-7-12/h6-9H,4-5,10H2,1-3H3,(H,19,22)(H2,18,20,23)