2-[2-(4-acetamidophenoxy)ethanoyl]-3-azanyl-5-methylsulfanyl-1,3-dihydropyrazole-4-carboxamide

Systemtic Name: 2-[2-(4-acetamidophenoxy)ethanoyl]-3-azanyl-5-methylsulfanyl-1,3-dihydropyrazole-4-carboxamide Openeye Name: 2-[2-(4-acetamidophenoxy)acetyl]-3-amino-5-methylsulfanyl-1,3-dihydropyrazole-4-carboxamide CAS Name: 2-[2-(4-acetamidophenoxy)-1-oxoethyl]-3-amino-5-(methylthio)-1,3-dihydropyrazole-4-carboxamide IUPAC Name: 2-[2-(4-acetamidophenoxy)acetyl]-3-amino-5-methylsulfanyl-1,3-dihydropyrazole-4-carboxamide Traditional Name: 1-[2-(4-acetamidophenoxy)acetyl]-5-amino-3-(methylthio)-3-pyrazoline-4-carboxamide Formula: C15H19N5O4S MolecularWeight: 365.40746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OCC(=O)N2C(C(=C(N2)SC)C(=O)N)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OCC(=O)N2C(C(=C(N2)SC)C(=O)N)N

InChI

InChI=1S/C15H19N5O4S/c1-8(21)18-9-3-5-10(6-4-9)24-7-11(22)20-13(16)12(14(17)23)15(19-20)25-2/h3-6,13,19H,7,16H2,1-2H3,(H2,17,23)(H,18,21)