methyl 3-[[1-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)piperidin-4-yl]carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[1-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)piperidin-4-yl]carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[1-(4-ethyl-3-oxo-quinoxalin-2-yl)-4-piperidyl]carbamoylamino]thiophene-2-carboxylate CAS Name: 3-[[[[1-(4-ethyl-3-oxo-2-quinoxalinyl)-4-piperidinyl]amino]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-(4-ethyl-3-oxoquinoxalin-2-yl)piperidin-4-yl]carbamoylamino]thiophene-2-carboxylate Traditional Name: 3-[[1-(4-ethyl-3-keto-quinoxalin-2-yl)-4-piperidyl]carbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C(C1=O)N3CCC(CC3)NC(=O)NC4=C(SC=C4)C(=O)OC

Isomeric SMILES

CCN1C2=CC=CC=C2N=C(C1=O)N3CCC(CC3)NC(=O)NC4=C(SC=C4)C(=O)OC

InChI

InChI=1S/C22H25N5O4S/c1-3-27-17-7-5-4-6-15(17)24-19(20(27)28)26-11-8-14(9-12-26)23-22(30)25-16-10-13-32-18(16)21(29)31-2/h4-7,10,13-14H,3,8-9,11-12H2,1-2H3,(H2,23,25,30)