phenylmethoxycarbonyl 2-azanyl-6-(carbamothioylamino)hexanoate

Systemtic Name: phenylmethoxycarbonyl 2-azanyl-6-(carbamothioylamino)hexanoate Openeye Name: benzyloxycarbonyl 2-amino-6-(carbamothioylamino)hexanoate CAS Name: 2-amino-6-(carbamothioylamino)hexanoic acid phenylmethoxycarbonyl ester IUPAC Name: phenylmethoxycarbonyl 2-amino-6-(carbamothioylamino)hexanoate Traditional Name: 2-amino-6-thioureido-hexanoic acid carbobenzoxy ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)OC(=O)C(CCCCNC(=S)N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)OC(=O)C(CCCCNC(=S)N)N

InChI

InChI=1S/C15H21N3O4S/c16-12(8-4-5-9-18-14(17)23)13(19)22-15(20)21-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,16H2,(H3,17,18,23)