tert-butyl N-[3-(phenylcarbamothioylamino)propyl]carbamate

Systemtic Name: tert-butyl N-[3-(phenylcarbamothioylamino)propyl]carbamate Openeye Name: tert-butyl N-[3-(phenylcarbamothioylamino)propyl]carbamate CAS Name: N-[3-[[anilino(sulfanylidene)methyl]amino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(phenylcarbamothioylamino)propyl]carbamate Traditional Name: N-[3-(phenylthiocarbamoylamino)propyl]carbamic acid tert-butyl ester Formula: C15H23N3O2S MolecularWeight: 309.42702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCNC(=S)NC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCNC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C15H23N3O2S/c1-15(2,3)20-14(19)17-11-7-10-16-13(21)18-12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3,(H,17,19)(H2,16,18,21)