O-tert-butyl N-(1-oxidanylidene-1-phenylazanyl-pentan-2-yl)carbamothioate

Systemtic Name: O-tert-butyl N-(1-oxidanylidene-1-phenylazanyl-pentan-2-yl)carbamothioate Openeye Name: O-tert-butyl N-[1-(phenylcarbamoyl)butyl]carbamothioate CAS Name: N-(1-anilino-1-oxopentan-2-yl)carbamothioic acid O-tert-butyl ester IUPAC Name: O-tert-butyl N-(1-anilino-1-oxopentan-2-yl)carbamothioate Traditional Name: N-[1-(phenylcarbamoyl)butyl]thiocarbamic acid O-tert-butyl ester Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC=CC=C1)NC(=S)OC(C)(C)C

Isomeric SMILES

CCCC(C(=O)NC1=CC=CC=C1)NC(=S)OC(C)(C)C

InChI

InChI=1S/C16H24N2O2S/c1-5-9-13(18-15(21)20-16(2,3)4)14(19)17-12-10-7-6-8-11-12/h6-8,10-11,13H,5,9H2,1-4H3,(H,17,19)(H,18,21)