2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylcarbamoyl)propanamide

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylcarbamoyl)propanamide Openeye Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylcarbamoyl)propanamide CAS Name: N-[anilino(oxo)methyl]-2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylcarbamoyl)propanamide Traditional Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(phenylcarbamoyl)propionamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NNC(=N2)C3CCCC3

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NNC(=N2)C3CCCC3

InChI

InChI=1S/C17H21N5O2S/c1-11(15(23)20-16(24)18-13-9-3-2-4-10-13)25-17-19-14(21-22-17)12-7-5-6-8-12/h2-4,9-12H,5-8H2,1H3,(H,19,21,22)(H2,18,20,23,24)