tert-butyl N-[2-methoxy-5-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-methoxy-5-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]phenyl]carbamate Openeye Name: tert-butyl N-[2-methoxy-5-[(1-phenyltriazole-4-carbonyl)amino]phenyl]carbamate CAS Name: N-[2-methoxy-5-[[oxo-(1-phenyl-4-triazolyl)methyl]amino]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-methoxy-5-[(1-phenyltriazole-4-carbonyl)amino]phenyl]carbamate Traditional Name: N-[2-methoxy-5-[(1-phenyltriazole-4-carbonyl)amino]phenyl]carbamic acid tert-butyl ester Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H23N5O4/c1-21(2,3)30-20(28)23-16-12-14(10-11-18(16)29-4)22-19(27)17-13-26(25-24-17)15-8-6-5-7-9-15/h5-13H,1-4H3,(H,22,27)(H,23,28)