(2S)-2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dimethyl-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dimethyl-2-phenyl-ethanamide Openeye Name: (2S)-2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-2-phenyl-acetamide CAS Name: (2S)-2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N,N-dimethyl-2-phenylacetamide IUPAC Name: (2S)-2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-dimethyl-2-phenylacetamide Traditional Name: (2S)-2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N,N-dimethyl-2-phenyl-acetamide Formula: C17H18N6OS MolecularWeight: 354.42942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)SC2=NN=C(N2N)C3=CN=CC=C3

Isomeric SMILES

CN(C)C(=O)[C@H](C1=CC=CC=C1)SC2=NN=C(N2N)C3=CN=CC=C3

InChI

InChI=1S/C17H18N6OS/c1-22(2)16(24)14(12-7-4-3-5-8-12)25-17-21-20-15(23(17)18)13-9-6-10-19-11-13/h3-11,14H,18H2,1-2H3/t14-/m0/s1