ethyl 2-[(4-methyl-2-oxidanylidene-1-piperidin-4-yl-pentyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-methyl-2-oxidanylidene-1-piperidin-4-yl-pentyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[4-methyl-2-oxo-1-(4-piperidyl)pentyl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[[4-methyl-2-oxo-1-(4-piperidinyl)pentyl]amino]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-methyl-2-oxo-1-piperidin-4-ylpentyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-keto-4-methyl-1-(4-piperidyl)pentyl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C23H35N3O4S MolecularWeight: 449.6067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)NC(C3CCNCC3)C(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)NC(C3CCNCC3)C(=O)CC(C)C

InChI

InChI=1S/C23H35N3O4S/c1-4-30-22(28)19-16-7-5-6-8-18(16)31-21(19)26-23(29)25-20(17(27)13-14(2)3)15-9-11-24-12-10-15/h14-15,20,24H,4-13H2,1-3H3,(H2,25,26,29)