tert-butyl N-[1-(6-aminocarbonyl-9H-pyrimido[4,5-b]indol-4-yl)piperidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-(6-aminocarbonyl-9H-pyrimido[4,5-b]indol-4-yl)piperidin-3-yl]carbamate Openeye Name: tert-butyl N-[1-(6-carbamoyl-9H-pyrimido[4,5-b]indol-4-yl)-3-piperidyl]carbamate CAS Name: N-[1-(6-carbamoyl-9H-pyrimido[4,5-b]indol-4-yl)-3-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(6-carbamoyl-9H-pyrimido[4,5-b]indol-4-yl)piperidin-3-yl]carbamate Traditional Name: N-[1-(6-carbamoyl-9H-pyrimid[4,5-b]indol-4-yl)-3-piperidyl]carbamic acid tert-butyl ester Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCCN(C1)C2=NC=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCCN(C1)C2=NC=NC3=C2C4=C(N3)C=CC(=C4)C(=O)N

InChI

InChI=1S/C21H26N6O3/c1-21(2,3)30-20(29)25-13-5-4-8-27(10-13)19-16-14-9-12(17(22)28)6-7-15(14)26-18(16)23-11-24-19/h6-7,9,11,13H,4-5,8,10H2,1-3H3,(H2,22,28)(H,25,29)(H,23,24,26)