N-(4-piperidin-1-ylsulfonylphenyl)-4H-thiochromeno[3,4-d][1,2]oxazole-3-carboxamide

Systemtic Name: N-(4-piperidin-1-ylsulfonylphenyl)-4H-thiochromeno[3,4-d][1,2]oxazole-3-carboxamide Openeye Name: N-[4-(1-piperidylsulfonyl)phenyl]-4H-thiochromeno[3,4-d]isoxazole-3-carboxamide CAS Name: N-[4-(1-piperidinylsulfonyl)phenyl]-4H-thiochromeno[3,4-d]isoxazole-3-carboxamide IUPAC Name: N-(4-piperidin-1-ylsulfonylphenyl)-4H-thiochromeno[3,4-d][1,2]oxazole-3-carboxamide Traditional Name: N-(4-piperidinosulfonylphenyl)-4H-thiochromen[3,4-d]isoxazole-3-carboxamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NOC4=C3CSC5=CC=CC=C54

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NOC4=C3CSC5=CC=CC=C54

InChI

InChI=1S/C22H21N3O4S2/c26-22(20-18-14-30-19-7-3-2-6-17(19)21(18)29-24-20)23-15-8-10-16(11-9-15)31(27,28)25-12-4-1-5-13-25/h2-3,6-11H,1,4-5,12-14H2,(H,23,26)