N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-[2-(methylamino)-2-oxo-ethyl]phenyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[4-[2-keto-2-(methylamino)ethyl]phenyl]-4-piperidinosulfonyl-benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25N3O4S/c1-22-20(25)15-16-5-9-18(10-6-16)23-21(26)17-7-11-19(12-8-17)29(27,28)24-13-3-2-4-14-24/h5-12H,2-4,13-15H2,1H3,(H,22,25)(H,23,26)