tert-butyl 4-[5-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]pyridin-2-yl]oxypiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]pyridin-2-yl]oxypiperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-(4-carbamoyl-5-ureido-2-thienyl)-2-pyridyl]oxy]piperidine-1-carboxylate CAS Name: 4-[[5-[4-carbamoyl-5-(carbamoylamino)-2-thiophenyl]-2-pyridinyl]oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-[4-carbamoyl-5-(carbamoylamino)thiophen-2-yl]pyridin-2-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[[5-(4-carbamoyl-5-ureido-2-thienyl)-2-pyridyl]oxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=NC=C(C=C2)C3=CC(=C(S3)NC(=O)N)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=NC=C(C=C2)C3=CC(=C(S3)NC(=O)N)C(=O)N

InChI

InChI=1S/C21H27N5O5S/c1-21(2,3)31-20(29)26-8-6-13(7-9-26)30-16-5-4-12(11-24-16)15-10-14(17(22)27)18(32-15)25-19(23)28/h4-5,10-11,13H,6-9H2,1-3H3,(H2,22,27)(H3,23,25,28)