4-chloranyl-N-[4-ethyl-5-methyl-3-[(phenylmethyl)carbamoyl]thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[4-ethyl-5-methyl-3-[(phenylmethyl)carbamoyl]thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[3-(benzylcarbamoyl)-4-ethyl-5-methyl-2-thienyl]-4-chloro-2-methyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[4-ethyl-5-methyl-3-[oxo-[(phenylmethyl)amino]methyl]-2-thiophenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(benzylcarbamoyl)-4-ethyl-5-methylthiophen-2-yl]-4-chloro-2-methylpyrazole-3-carboxamide Traditional Name: N-[3-(benzylcarbamoyl)-4-ethyl-5-methyl-2-thienyl]-4-chloro-2-methyl-pyrazole-3-carboxamide Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)NCC2=CC=CC=C2)NC(=O)C3=C(C=NN3C)Cl)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)NCC2=CC=CC=C2)NC(=O)C3=C(C=NN3C)Cl)C

InChI

InChI=1S/C20H21ClN4O2S/c1-4-14-12(2)28-20(24-19(27)17-15(21)11-23-25(17)3)16(14)18(26)22-10-13-8-6-5-7-9-13/h5-9,11H,4,10H2,1-3H3,(H,22,26)(H,24,27)