tert-butyl 3-[4-[(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamoyl]pyridin-2-yl]propanoate

Systemtic Name: tert-butyl 3-[4-[(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamoyl]pyridin-2-yl]propanoate Openeye Name: tert-butyl 3-[4-[(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)carbamoyl]-2-pyridyl]propanoate CAS Name: 3-[4-[[[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]amino]-oxomethyl]-2-pyridinyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamoyl]pyridin-2-yl]propanoate Traditional Name: 3-[4-[(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)carbamoyl]-2-pyridyl]propionic acid tert-butyl ester Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

InChI

InChI=1S/C25H30N4O5S/c1-25(2,3)34-20(30)8-5-17-15-16(9-10-26-17)23(31)28-24-27-21-19(32-4)7-6-18(22(21)35-24)29-11-13-33-14-12-29/h6-7,9-10,15H,5,8,11-14H2,1-4H3,(H,27,28,31)