5-phenoxy-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]furan-2-carboxamide

Systemtic Name: 5-phenoxy-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]furan-2-carboxamide Openeye Name: 5-phenoxy-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]furan-2-carboxamide CAS Name: N-[3-[4-[oxo(thiomorpholin-4-yl)methyl]-1-triazolyl]propyl]-5-phenoxy-2-furancarboxamide IUPAC Name: 5-phenoxy-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]furan-2-carboxamide Traditional Name: 5-phenoxy-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]-2-furamide Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)C2=CN(N=N2)CCCNC(=O)C3=CC=C(O3)OC4=CC=CC=C4

Isomeric SMILES

C1CSCCN1C(=O)C2=CN(N=N2)CCCNC(=O)C3=CC=C(O3)OC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O4S/c27-20(18-7-8-19(30-18)29-16-5-2-1-3-6-16)22-9-4-10-26-15-17(23-24-26)21(28)25-11-13-31-14-12-25/h1-3,5-8,15H,4,9-14H2,(H,22,27)