tert-butyl 4-[(2-methoxyphenyl)methylcarbamothioylamino]butanoate

Systemtic Name: tert-butyl 4-[(2-methoxyphenyl)methylcarbamothioylamino]butanoate Openeye Name: tert-butyl 4-[(2-methoxyphenyl)methylcarbamothioylamino]butanoate CAS Name: 4-[[[(2-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-methoxyphenyl)methylcarbamothioylamino]butanoate Traditional Name: 4-(o-anisylthiocarbamoylamino)butyric acid tert-butyl ester Formula: C17H26N2O3S MolecularWeight: 338.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCCNC(=S)NCC1=CC=CC=C1OC

Isomeric SMILES

CC(C)(C)OC(=O)CCCNC(=S)NCC1=CC=CC=C1OC

InChI

InChI=1S/C17H26N2O3S/c1-17(2,3)22-15(20)10-7-11-18-16(23)19-12-13-8-5-6-9-14(13)21-4/h5-6,8-9H,7,10-12H2,1-4H3,(H2,18,19,23)