tert-butyl N-[[3-(carbamothioylamino)phenyl]methyl]-N-ethyl-carbamate

Systemtic Name: tert-butyl N-[[3-(carbamothioylamino)phenyl]methyl]-N-ethyl-carbamate Openeye Name: tert-butyl N-[[3-(carbamothioylamino)phenyl]methyl]-N-ethyl-carbamate CAS Name: N-[[3-(carbamothioylamino)phenyl]methyl]-N-ethylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-(carbamothioylamino)phenyl]methyl]-N-ethylcarbamate Traditional Name: N-ethyl-N-(3-thioureidobenzyl)carbamic acid tert-butyl ester Formula: C15H23N3O2S MolecularWeight: 309.42702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)NC(=S)N)C(=O)OC(C)(C)C

Isomeric SMILES

CCN(CC1=CC(=CC=C1)NC(=S)N)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H23N3O2S/c1-5-18(14(19)20-15(2,3)4)10-11-7-6-8-12(9-11)17-13(16)21/h6-9H,5,10H2,1-4H3,(H3,16,17,21)