ethyl 2-[(1-cyclopropylcarbonylpiperidin-4-yl)methylcarbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(1-cyclopropylcarbonylpiperidin-4-yl)methylcarbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(cyclopropanecarbonyl)-4-piperidyl]methylcarbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[[[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]methylamino]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(cyclopropanecarbonyl)piperidin-4-yl]methylcarbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[1-(cyclopropanecarbonyl)-4-piperidyl]methylcarbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)NCC3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)NCC3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C22H31N3O4S/c1-2-29-21(27)18-16-5-3-4-6-17(16)30-19(18)24-22(28)23-13-14-9-11-25(12-10-14)20(26)15-7-8-15/h14-15H,2-13H2,1H3,(H2,23,24,28)