N-[1-(4-butan-2-ylphenyl)propyl]-3-(4-chloranyl-3-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-3-(4-chloranyl-3-methyl-pyrazol-1-yl)propanamide Openeye Name: 3-(4-chloro-3-methyl-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propanamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-3-(4-chloro-3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-3-(4-chloro-3-methylpyrazol-1-yl)propanamide Traditional Name: 3-(4-chloro-3-methyl-pyrazol-1-yl)-N-[1-(4-sec-butylphenyl)propyl]propionamide Formula: C20H28ClN3O MolecularWeight: 361.90882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)CCN2C=C(C(=N2)C)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)CCN2C=C(C(=N2)C)Cl

InChI

InChI=1S/C20H28ClN3O/c1-5-14(3)16-7-9-17(10-8-16)19(6-2)22-20(25)11-12-24-13-18(21)15(4)23-24/h7-10,13-14,19H,5-6,11-12H2,1-4H3,(H,22,25)