(2S)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enyl-propanamide

Systemtic Name: (2S)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enyl-propanamide Openeye Name: (2S)-N-allyl-2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2S)-2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-prop-2-enylpropanamide IUPAC Name: (2S)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enylpropanamide Traditional Name: (2S)-N-allyl-2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H25N5OS MolecularWeight: 335.4676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NN=C(N1C2CC2)N3CCCCC3

Isomeric SMILES

C[C@@H](C(=O)NCC=C)SC1=NN=C(N1C2CC2)N3CCCCC3

InChI

InChI=1S/C16H25N5OS/c1-3-9-17-14(22)12(2)23-16-19-18-15(21(16)13-7-8-13)20-10-5-4-6-11-20/h3,12-13H,1,4-11H2,2H3,(H,17,22)/t12-/m0/s1