2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]thio]-N-[2-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-pyrrolidinophenyl)acetamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3N4CCCC4

Isomeric SMILES

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC=CC=C3N4CCCC4

InChI

InChI=1S/C22H25N5OS/c1-2-17-9-3-5-11-19(17)27-16-23-25-22(27)29-15-21(28)24-18-10-4-6-12-20(18)26-13-7-8-14-26/h3-6,9-12,16H,2,7-8,13-15H2,1H3,(H,24,28)