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

Systemtic Name: ethyl 2-[(3-ethyl-2-oxidanylidene-1-piperidin-4-yl-heptyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[3-ethyl-2-oxo-1-(4-piperidyl)heptyl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[[3-ethyl-2-oxo-1-(4-piperidinyl)heptyl]amino]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-ethyl-2-oxo-1-piperidin-4-ylheptyl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[3-ethyl-2-keto-1-(4-piperidyl)heptyl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C26H41N3O4S MolecularWeight: 491.68644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)C(C1CCNCC1)NC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OCC

Isomeric SMILES

CCCCC(CC)C(=O)C(C1CCNCC1)NC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OCC

InChI

InChI=1S/C26H41N3O4S/c1-4-7-10-17(5-2)23(30)22(18-13-15-27-16-14-18)28-26(32)29-24-21(25(31)33-6-3)19-11-8-9-12-20(19)34-24/h17-18,22,27H,4-16H2,1-3H3,(H2,28,29,32)