N-[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-2-phenyl-ethanamide Openeye Name: N-[2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2-phenyl-acetamide CAS Name: N-[2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-phenylacetamide IUPAC Name: N-[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-phenylacetamide Traditional Name: N-[2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-2-phenyl-acetamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC(=O)NC(=O)CC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1CC1N2C(=NN=C2SCC(=O)NC(=O)CC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C20H19N5O2S/c26-17(11-14-5-2-1-3-6-14)22-18(27)13-28-20-24-23-19(25(20)16-8-9-16)15-7-4-10-21-12-15/h1-7,10,12,16H,8-9,11,13H2,(H,22,26,27)