(2R)-N,N-dimethyl-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N,N-dimethyl-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N,N-dimethyl-2-[[4-phenyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N,N-dimethyl-2-[[4-phenyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N,N-dimethyl-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N,N-dimethyl-2-[(4-phenyl-5-piperidino-1,2,4-triazol-3-yl)thio]propionamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)SC1=NN=C(N1C2=CC=CC=C2)N3CCCCC3

Isomeric SMILES

C[C@H](C(=O)N(C)C)SC1=NN=C(N1C2=CC=CC=C2)N3CCCCC3

InChI

InChI=1S/C18H25N5OS/c1-14(16(24)21(2)3)25-18-20-19-17(22-12-8-5-9-13-22)23(18)15-10-6-4-7-11-15/h4,6-7,10-11,14H,5,8-9,12-13H2,1-3H3/t14-/m1/s1