5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-(4-methylbenzyl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]pyrazole-4-carboxamide Formula: C23H27ClN4O2S MolecularWeight: 459.00408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NCC(C3=CC=CS3)N4CCOCC4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC[C@@H](C3=CC=CS3)N4CCOCC4)Cl

InChI

InChI=1S/C23H27ClN4O2S/c1-16-5-7-18(8-6-16)15-28-22(24)21(17(2)26-28)23(29)25-14-19(20-4-3-13-31-20)27-9-11-30-12-10-27/h3-8,13,19H,9-12,14-15H2,1-2H3,(H,25,29)/t19-/m0/s1