methyl 4-[[1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carbonyl]amino]butanoate CAS Name: 4-[[[1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carbonyl]amino]butanoate Traditional Name: 4-[[1-[(5-methyl-2-thienyl)sulfonyl]nipecotoyl]amino]butyric acid methyl ester Formula: C16H24N2O5S2 MolecularWeight: 388.50216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCC(=O)OC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCCCC(=O)OC

InChI

InChI=1S/C16H24N2O5S2/c1-12-7-8-15(24-12)25(21,22)18-10-4-5-13(11-18)16(20)17-9-3-6-14(19)23-2/h7-8,13H,3-6,9-11H2,1-2H3,(H,17,20)