2-[(2S)-2-azanyl-5-[bis(phenylmethoxycarbonylamino)methylideneamino]pentanoyl]sulfanylethanoic acid

Systemtic Name: 2-[(2S)-2-azanyl-5-[bis(phenylmethoxycarbonylamino)methylideneamino]pentanoyl]sulfanylethanoic acid Openeye Name: 2-[(2S)-2-amino-5-[bis(benzyloxycarbonylamino)methyleneamino]pentanoyl]sulfanylacetic acid CAS Name: 2-[[(2S)-2-amino-5-[bis(phenylmethoxycarbonylamino)methylideneamino]-1-oxopentyl]thio]acetic acid IUPAC Name: 2-[(2S)-2-amino-5-[bis(phenylmethoxycarbonylamino)methylideneamino]pentanoyl]sulfanylacetic acid Traditional Name: 2-[[(2S)-2-amino-5-[bis(benzyloxycarbonylamino)methyleneamino]pentanoyl]thio]acetic acid Formula: C24H28N4O7S MolecularWeight: 516.56672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(=NCCCC(C(=O)SCC(=O)O)N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(=NCCC[C@@H](C(=O)SCC(=O)O)N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H28N4O7S/c25-19(21(31)36-16-20(29)30)12-7-13-26-22(27-23(32)34-14-17-8-3-1-4-9-17)28-24(33)35-15-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16,25H2,(H,29,30)(H2,26,27,28,32,33)/t19-/m0/s1