tert-butyl 4-[(4-tert-butylphenyl)carbamothioylamino]butanoate

Systemtic Name: tert-butyl 4-[(4-tert-butylphenyl)carbamothioylamino]butanoate Openeye Name: tert-butyl 4-[(4-tert-butylphenyl)carbamothioylamino]butanoate CAS Name: 4-[[(4-tert-butylanilino)-sulfanylidenemethyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-tert-butylphenyl)carbamothioylamino]butanoate Traditional Name: 4-[(4-tert-butylphenyl)thiocarbamoylamino]butyric acid tert-butyl ester Formula: C19H30N2O2S MolecularWeight: 350.5187

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O2S/c1-18(2,3)14-9-11-15(12-10-14)21-17(24)20-13-7-8-16(22)23-19(4,5)6/h9-12H,7-8,13H2,1-6H3,(H2,20,21,24)