tert-butyl N-[[5-(3,3-dimethylbutan-2-ylcarbamothioylamino)pyridin-2-yl]amino]carbamate

Systemtic Name: tert-butyl N-[[5-(3,3-dimethylbutan-2-ylcarbamothioylamino)pyridin-2-yl]amino]carbamate Openeye Name: tert-butyl N-[[5-(1,2,2-trimethylpropylcarbamothioylamino)-2-pyridyl]amino]carbamate CAS Name: N-[[5-[[(3,3-dimethylbutan-2-ylamino)-sulfanylidenemethyl]amino]-2-pyridinyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[5-(3,3-dimethylbutan-2-ylcarbamothioylamino)pyridin-2-yl]amino]carbamate Traditional Name: N-[[5-(1,2,2-trimethylpropylthiocarbamoylamino)-2-pyridyl]amino]carbamic acid tert-butyl ester Formula: C17H29N5O2S MolecularWeight: 367.50946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC(=S)NC1=CN=C(C=C1)NNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C(C)(C)C)NC(=S)NC1=CN=C(C=C1)NNC(=O)OC(C)(C)C

InChI

InChI=1S/C17H29N5O2S/c1-11(16(2,3)4)19-14(25)20-12-8-9-13(18-10-12)21-22-15(23)24-17(5,6)7/h8-11H,1-7H3,(H,18,21)(H,22,23)(H2,19,20,25)