3-[(5-aminocarbonyl-1-methyl-3-propyl-pyrazol-4-yl)carbamoyl]-4-ethoxy-benzenesulfonyl chloride

Systemtic Name: 3-[(5-aminocarbonyl-1-methyl-3-propyl-pyrazol-4-yl)carbamoyl]-4-ethoxy-benzenesulfonyl chloride Openeye Name: 3-[(5-carbamoyl-1-methyl-3-propyl-pyrazol-4-yl)carbamoyl]-4-ethoxy-benzenesulfonyl chloride CAS Name: 3-[[(5-carbamoyl-1-methyl-3-propyl-4-pyrazolyl)amino]-oxomethyl]-4-ethoxybenzenesulfonyl chloride IUPAC Name: 3-[(5-carbamoyl-1-methyl-3-propylpyrazol-4-yl)carbamoyl]-4-ethoxybenzenesulfonyl chloride Traditional Name: 3-[(5-carbamoyl-1-methyl-3-propyl-pyrazol-4-yl)carbamoyl]-4-ethoxy-benzenesulfonyl chloride Formula: C17H21ClN4O5S MolecularWeight: 428.89044

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)Cl)OCC)C(=O)N)C

Isomeric SMILES

CCCC1=NN(C(=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)Cl)OCC)C(=O)N)C

InChI

InChI=1S/C17H21ClN4O5S/c1-4-6-12-14(15(16(19)23)22(3)21-12)20-17(24)11-9-10(28(18,25)26)7-8-13(11)27-5-2/h7-9H,4-6H2,1-3H3,(H2,19,23)(H,20,24)