N-[[4-(diethylaminomethyl)phenyl]methyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-2-(1-methyl-4-pyrazolyl)-4-thiazolecarboxamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2=CSC(=N2)C3=CN(N=C3)C

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2=CSC(=N2)C3=CN(N=C3)C

InChI

InChI=1S/C20H25N5OS/c1-4-25(5-2)12-16-8-6-15(7-9-16)10-21-19(26)18-14-27-20(23-18)17-11-22-24(3)13-17/h6-9,11,13-14H,4-5,10,12H2,1-3H3,(H,21,26)