N-[3-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)-1,3-thiazol-2-ylidene]adamantane-1-carboxamide

Systemtic Name: N-[3-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)-1,3-thiazol-2-ylidene]adamantane-1-carboxamide Openeye Name: N-[3-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)thiazol-2-ylidene]adamantane-1-carboxamide CAS Name: N-[3-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)-2-thiazolylidene]-1-adamantanecarboxamide IUPAC Name: N-[3-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)-1,3-thiazol-2-ylidene]adamantane-1-carboxamide Traditional Name: N-[3-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)-4-thiazolin-2-ylidene]adamantane-1-carboxamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=C(SC1=NC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=NN5

Isomeric SMILES

COCCN1C=C(SC1=NC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=NN5

InChI

InChI=1S/C20H26N4O2S/c1-26-5-4-24-12-17(16-2-3-21-23-16)27-19(24)22-18(25)20-9-13-6-14(10-20)8-15(7-13)11-20/h2-3,12-15H,4-11H2,1H3,(H,21,23)