7-methyl-N-(3-piperidin-1-ylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 7-methyl-N-(3-piperidin-1-ylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 7-methyl-N-[3-(1-piperidylsulfonyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 7-methyl-N-[3-(1-piperidinylsulfonyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide IUPAC Name: 7-methyl-N-(3-piperidin-1-ylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 7-methyl-N-(3-piperidinosulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NC2=NC(=NN12)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=NC2=NC(=NN12)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C18H20N6O3S/c1-13-8-9-19-18-21-16(22-24(13)18)17(25)20-14-6-5-7-15(12-14)28(26,27)23-10-3-2-4-11-23/h5-9,12H,2-4,10-11H2,1H3,(H,20,25)