N-[4-(tert-butylcarbamoyl)phenyl]-5-piperidin-1-ylsulfonyl-furan-2-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-5-piperidin-1-ylsulfonyl-furan-2-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-5-(1-piperidylsulfonyl)furan-2-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-5-(1-piperidinylsulfonyl)-2-furancarboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-5-piperidin-1-ylsulfonylfuran-2-carboxamide Traditional Name: N-[4-(tert-butylcarbamoyl)phenyl]-5-piperidinosulfonyl-2-furamide Formula: C21H27N3O5S MolecularWeight: 433.52118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O5S/c1-21(2,3)23-19(25)15-7-9-16(10-8-15)22-20(26)17-11-12-18(29-17)30(27,28)24-13-5-4-6-14-24/h7-12H,4-6,13-14H2,1-3H3,(H,22,26)(H,23,25)