tert-butyl N-[1-(2-aminocarbonyl-3-azanyl-4-propyl-thieno[2,3-b]pyridin-6-yl)piperidin-4-yl]carbamate

Systemtic Name: tert-butyl N-[1-(2-aminocarbonyl-3-azanyl-4-propyl-thieno[2,3-b]pyridin-6-yl)piperidin-4-yl]carbamate Openeye Name: tert-butyl N-[1-(3-amino-2-carbamoyl-4-propyl-thieno[2,3-b]pyridin-6-yl)-4-piperidyl]carbamate CAS Name: N-[1-(3-amino-2-carbamoyl-4-propyl-6-thieno[2,3-b]pyridinyl)-4-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(3-amino-2-carbamoyl-4-propylthieno[2,3-b]pyridin-6-yl)piperidin-4-yl]carbamate Traditional Name: N-[1-(3-amino-2-carbamoyl-4-propyl-thieno[2,3-b]pyridin-6-yl)-4-piperidyl]carbamic acid tert-butyl ester Formula: C21H31N5O3S MolecularWeight: 433.56754

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)N)N)N3CCC(CC3)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)N)N)N3CCC(CC3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H31N5O3S/c1-5-6-12-11-14(25-19-15(12)16(22)17(30-19)18(23)27)26-9-7-13(8-10-26)24-20(28)29-21(2,3)4/h11,13H,5-10,22H2,1-4H3,(H2,23,27)(H,24,28)