3-acetamido-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-3-(2-thienyl)propionamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)CC(C2=CC=CS2)NC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)CC(C2=CC=CS2)NC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-16-18(15-26(25-16)19-9-4-3-5-10-19)8-6-12-23-22(28)14-20(24-17(2)27)21-11-7-13-29-21/h3-5,7,9-11,13,15,20H,6,8,12,14H2,1-2H3,(H,23,28)(H,24,27)