2-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)propanamide

Systemtic Name: 2-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)propanamide Openeye Name: 2-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)propanamide CAS Name: 2-[[4-amino-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylphenyl)propanamide IUPAC Name: 2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)propanamide Traditional Name: 2-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-(2-phenylphenyl)propionamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)SC3=NN=C(N3N)C4=CC=CO4

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)SC3=NN=C(N3N)C4=CC=CO4

InChI

InChI=1S/C21H19N5O2S/c1-14(29-21-25-24-19(26(21)22)18-12-7-13-28-18)20(27)23-17-11-6-5-10-16(17)15-8-3-2-4-9-15/h2-14H,22H2,1H3,(H,23,27)