tert-butyl 2-methyl-3-[(Z)-[2-oxidanylidene-2-(pyridin-4-ylamino)-1-[2-[(triphenylmethyl)amino]-1,3-thiazol-4-yl]ethylidene]amino]oxy-propanoate

Systemtic Name: tert-butyl 2-methyl-3-[(Z)-[2-oxidanylidene-2-(pyridin-4-ylamino)-1-[2-[(triphenylmethyl)amino]-1,3-thiazol-4-yl]ethylidene]amino]oxy-propanoate Openeye Name: tert-butyl 2-methyl-3-[(Z)-[2-oxo-2-(4-pyridylamino)-1-[2-(tritylamino)thiazol-4-yl]ethylidene]amino]oxy-propanoate CAS Name: 2-methyl-3-[(Z)-[2-oxo-2-(pyridin-4-ylamino)-1-[2-[(triphenylmethyl)amino]-4-thiazolyl]ethylidene]amino]oxypropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-methyl-3-[(Z)-[2-oxo-2-(pyridin-4-ylamino)-1-[2-(tritylamino)-1,3-thiazol-4-yl]ethylidene]amino]oxypropanoate Traditional Name: 3-[(Z)-[2-keto-2-(4-pyridylamino)-1-[2-(tritylamino)thiazol-4-yl]ethylidene]amino]oxy-2-methyl-propionic acid tert-butyl ester Formula: C37H37N5O4S MolecularWeight: 647.78578

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Descriptors Computed from Structure

Canonical SMILES:

CC(CON=C(C1=CSC(=N1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC5=CC=NC=C5)C(=O)OC(C)(C)C

Isomeric SMILES

CC(CO/N=C(/C1=CSC(=N1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)\C(=O)NC5=CC=NC=C5)C(=O)OC(C)(C)C

InChI

InChI=1S/C37H37N5O4S/c1-26(34(44)46-36(2,3)4)24-45-42-32(33(43)39-30-20-22-38-23-21-30)31-25-47-35(40-31)41-37(27-14-8-5-9-15-27,28-16-10-6-11-17-28)29-18-12-7-13-19-29/h5-23,25-26H,24H2,1-4H3,(H,40,41)(H,38,39,43)/b42-32-