3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide

Systemtic Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide Openeye Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide CAS Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(4-ethoxyphenyl)propanamide IUPAC Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide Traditional Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-p-phenetyl-propionamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C22H24N4O2S/c1-2-28-19-12-10-17(11-13-19)23-20(27)14-15-29-22-25-24-21(16-8-9-16)26(22)18-6-4-3-5-7-18/h3-7,10-13,16H,2,8-9,14-15H2,1H3,(H,23,27)