[4-(prop-2-enylcarbamothioylamino)phenyl] N-tert-butylcarbamate

Systemtic Name: [4-(prop-2-enylcarbamothioylamino)phenyl] N-tert-butylcarbamate Openeye Name: [4-(allylcarbamothioylamino)phenyl] N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid [4-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]phenyl] ester IUPAC Name: [4-(prop-2-enylcarbamothioylamino)phenyl] N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid [4-(allylthiocarbamoylamino)phenyl] ester Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)OC1=CC=C(C=C1)NC(=S)NCC=C

Isomeric SMILES

CC(C)(C)NC(=O)OC1=CC=C(C=C1)NC(=S)NCC=C

InChI

InChI=1S/C15H21N3O2S/c1-5-10-16-13(21)17-11-6-8-12(9-7-11)20-14(19)18-15(2,3)4/h5-9H,1,10H2,2-4H3,(H,18,19)(H2,16,17,21)