tert-butyl N-[3-(1H-imidazol-5-yl)-1-oxidanylidene-1-[2-(5-pyridin-2-ylthiophen-2-yl)carbonylhydrazinyl]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(1H-imidazol-5-yl)-1-oxidanylidene-1-[2-(5-pyridin-2-ylthiophen-2-yl)carbonylhydrazinyl]propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(1H-imidazol-5-ylmethyl)-2-oxo-2-[2-[5-(2-pyridyl)thiophene-2-carbonyl]hydrazino]ethyl]carbamate CAS Name: N-[3-(1H-imidazol-5-yl)-1-oxo-1-[[oxo-[5-(2-pyridinyl)-2-thiophenyl]methyl]hydrazo]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(1H-imidazol-5-yl)-1-oxo-1-[2-(5-pyridin-2-ylthiophene-2-carbonyl)hydrazinyl]propan-2-yl]carbamate Traditional Name: N-[1-(1H-imidazol-5-ylmethyl)-2-keto-2-[N'-[5-(2-pyridyl)thiophene-2-carbonyl]hydrazino]ethyl]carbamic acid tert-butyl ester Formula: C21H24N6O4S MolecularWeight: 456.51806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CN=CN1)C(=O)NNC(=O)C2=CC=C(S2)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CN=CN1)C(=O)NNC(=O)C2=CC=C(S2)C3=CC=CC=N3

InChI

InChI=1S/C21H24N6O4S/c1-21(2,3)31-20(30)25-15(10-13-11-22-12-24-13)18(28)26-27-19(29)17-8-7-16(32-17)14-6-4-5-9-23-14/h4-9,11-12,15H,10H2,1-3H3,(H,22,24)(H,25,30)(H,26,28)(H,27,29)