N-[7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide Traditional Name: 3-besyl-N-[7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propionamide Formula: C21H19N5O4S MolecularWeight: 437.47166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=NC3=NC(=NN23)NC(=O)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=NC3=NC(=NN23)NC(=O)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O4S/c1-30-16-9-7-15(8-10-16)18-11-13-22-21-24-20(25-26(18)21)23-19(27)12-14-31(28,29)17-5-3-2-4-6-17/h2-11,13H,12,14H2,1H3,(H,23,25,27)