methyl 2-[4-(carbamothioylamino)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoate

Systemtic Name: methyl 2-[4-(carbamothioylamino)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-2-[4-(carbamothioylamino)phenyl]acetate CAS Name: 2-[4-(carbamothioylamino)phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[4-(carbamothioylamino)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate Traditional Name: 2-(tert-butoxycarbonylamino)-2-(4-thioureidophenyl)acetic acid methyl ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O4S/c1-15(2,3)22-14(20)18-11(12(19)21-4)9-5-7-10(8-6-9)17-13(16)23/h5-8,11H,1-4H3,(H,18,20)(H3,16,17,23)