4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]butanamide

Systemtic Name: 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]butanamide Openeye Name: 4-(2,5-dimethyl-3-thienyl)-4-oxo-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]butanamide CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-4-oxo-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]butanamide IUPAC Name: 4-(2,5-dimethylthiophen-3-yl)-4-oxo-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]butanamide Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-N-(4-piperidinosulfonylbenzyl)butyramide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28N2O4S2/c1-16-14-20(17(2)29-16)21(25)10-11-22(26)23-15-18-6-8-19(9-7-18)30(27,28)24-12-4-3-5-13-24/h6-9,14H,3-5,10-13,15H2,1-2H3,(H,23,26)