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

Systemtic Name: (2S)-2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide Openeye Name: (2S)-2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: (2S)-2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide IUPAC Name: (2S)-2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylpropanamide Traditional Name: (2S)-2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2C3CC3)C4=CN=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)SC2=NN=C(N2C3CC3)C4=CN=CC=C4

InChI

InChI=1S/C19H19N5OS/c1-13(18(25)21-15-7-3-2-4-8-15)26-19-23-22-17(24(19)16-9-10-16)14-6-5-11-20-12-14/h2-8,11-13,16H,9-10H2,1H3,(H,21,25)/t13-/m0/s1