tert-butyl 4-[(2-ethoxyphenyl)carbamothioylamino]butanoate

Systemtic Name: tert-butyl 4-[(2-ethoxyphenyl)carbamothioylamino]butanoate Openeye Name: tert-butyl 4-[(2-ethoxyphenyl)carbamothioylamino]butanoate CAS Name: 4-[[(2-ethoxyanilino)-sulfanylidenemethyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-ethoxyphenyl)carbamothioylamino]butanoate Traditional Name: 4-(o-phenetylthiocarbamoylamino)butyric acid tert-butyl ester Formula: C17H26N2O3S MolecularWeight: 338.46494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)NCCCC(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)NCCCC(=O)OC(C)(C)C

InChI

InChI=1S/C17H26N2O3S/c1-5-21-14-10-7-6-9-13(14)19-16(23)18-12-8-11-15(20)22-17(2,3)4/h6-7,9-10H,5,8,11-12H2,1-4H3,(H2,18,19,23)