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

Systemtic Name: N-propan-2-yl-1-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]cyclohexyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-isopropyl-1-[4-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]cyclohexyl]triazole-4-carboxamide CAS Name: 1-[4-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]cyclohexyl]-N-propan-2-yl-4-triazolecarboxamide IUPAC Name: N-propan-2-yl-1-[4-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]cyclohexyl]triazole-4-carboxamide Traditional Name: N-isopropyl-1-[4-[[(E)-3-(2-thienyl)acryloyl]amino]cyclohexyl]triazole-4-carboxamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O2S/c1-13(2)20-19(26)17-12-24(23-22-17)15-7-5-14(6-8-15)21-18(25)10-9-16-4-3-11-27-16/h3-4,9-15H,5-8H2,1-2H3,(H,20,26)(H,21,25)/b10-9+