5-chloranyl-3-methyl-1-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-1-phenyl-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-phenyl-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-phenyl-N-[2-pyrrolidino-2-(2-thienyl)ethyl]pyrazole-4-carboxamide Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC(C2=CC=CS2)N3CCCC3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC(C2=CC=CS2)N3CCCC3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H23ClN4OS/c1-15-19(20(22)26(24-15)16-8-3-2-4-9-16)21(27)23-14-17(18-10-7-13-28-18)25-11-5-6-12-25/h2-4,7-10,13,17H,5-6,11-12,14H2,1H3,(H,23,27)