tert-butyl N-[4-[[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[[4-methyl-3-[[4-(3-pyridyl)thiazol-2-yl]amino]phenyl]carbamoyl]phenyl]carbamate CAS Name: N-[4-[[4-methyl-3-[[4-(3-pyridinyl)-2-thiazolyl]amino]anilino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]carbamoyl]phenyl]carbamate Traditional Name: N-[4-[[4-methyl-3-[[4-(3-pyridyl)thiazol-2-yl]amino]phenyl]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C27H27N5O3S MolecularWeight: 501.59998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)OC(C)(C)C)NC3=NC(=CS3)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)OC(C)(C)C)NC3=NC(=CS3)C4=CN=CC=C4

InChI

InChI=1S/C27H27N5O3S/c1-17-7-10-21(14-22(17)31-25-32-23(16-36-25)19-6-5-13-28-15-19)29-24(33)18-8-11-20(12-9-18)30-26(34)35-27(2,3)4/h5-16H,1-4H3,(H,29,33)(H,30,34)(H,31,32)