2-[ethyl-[2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[ethyl-[2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[ethyl-[2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-isopropyl-acetamide CAS Name: 2-[ethyl-[1-oxo-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[ethyl-[2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-propan-2-ylacetamide Traditional Name: 2-[ethyl-[2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-N-isopropyl-acetamide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)C)C(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CCN(CC(=O)NC(C)C)C(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C21H25N5O2S2/c1-4-25(13-18(27)22-15(2)3)19(28)14-30-21-24-23-20(17-11-8-12-29-17)26(21)16-9-6-5-7-10-16/h5-12,15H,4,13-14H2,1-3H3,(H,22,27)