4-tert-butyl-N-[3-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-methyl-5-(1-piperidylsulfonyl)anilino]-3-oxo-propyl]benzamide CAS Name: 4-tert-butyl-N-[3-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-3-oxopropyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(2-methyl-5-piperidin-1-ylsulfonylanilino)-3-oxopropyl]benzamide Traditional Name: 4-tert-butyl-N-[3-keto-3-(2-methyl-5-piperidinosulfonyl-anilino)propyl]benzamide Formula: C26H35N3O4S MolecularWeight: 485.6388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCNC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCNC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H35N3O4S/c1-19-8-13-22(34(32,33)29-16-6-5-7-17-29)18-23(19)28-24(30)14-15-27-25(31)20-9-11-21(12-10-20)26(2,3)4/h8-13,18H,5-7,14-17H2,1-4H3,(H,27,31)(H,28,30)