N,N-diethyl-1-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]cyclohexyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N,N-diethyl-1-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]cyclohexyl]-1,2,3-triazole-4-carboxamide Openeye Name: N,N-diethyl-1-[4-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]cyclohexyl]triazole-4-carboxamide CAS Name: N,N-diethyl-1-[4-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]cyclohexyl]-4-triazolecarboxamide IUPAC Name: N,N-diethyl-1-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]cyclohexyl]triazole-4-carboxamide Traditional Name: N,N-diethyl-1-[4-[[(E)-3-(2-thienyl)acryloyl]amino]cyclohexyl]triazole-4-carboxamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)C=CC3=CC=CS3

Isomeric SMILES

CCN(CC)C(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C20H27N5O2S/c1-3-24(4-2)20(27)18-14-25(23-22-18)16-9-7-15(8-10-16)21-19(26)12-11-17-6-5-13-28-17/h5-6,11-16H,3-4,7-10H2,1-2H3,(H,21,26)/b12-11+