S-naphthalen-2-yl 2-[2,5-bis[(2-methylpropan-2-yl)oxycarbonylamino]pentanoylamino]-3-phenyl-propanethioate

Systemtic Name: S-naphthalen-2-yl 2-[2,5-bis[(2-methylpropan-2-yl)oxycarbonylamino]pentanoylamino]-3-phenyl-propanethioate Openeye Name: S-(2-naphthyl) 2-[2,5-bis(tert-butoxycarbonylamino)pentanoylamino]-3-phenyl-propanethioate CAS Name: 2-[[2,5-bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-3-phenylpropanethioic acid S-(2-naphthalenyl) ester IUPAC Name: S-naphthalen-2-yl 2-[2,5-bis[(2-methylpropan-2-yl)oxycarbonylamino]pentanoylamino]-3-phenylpropanethioate Traditional Name: 2-[2,5-bis(tert-butoxycarbonylamino)pentanoylamino]-3-phenyl-propanethioic acid S-(2-naphthyl) ester Formula: C34H43N3O6S MolecularWeight: 621.78672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(C(=O)NC(CC1=CC=CC=C1)C(=O)SC2=CC3=CC=CC=C3C=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(C(=O)NC(CC1=CC=CC=C1)C(=O)SC2=CC3=CC=CC=C3C=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C34H43N3O6S/c1-33(2,3)42-31(40)35-20-12-17-27(37-32(41)43-34(4,5)6)29(38)36-28(21-23-13-8-7-9-14-23)30(39)44-26-19-18-24-15-10-11-16-25(24)22-26/h7-11,13-16,18-19,22,27-28H,12,17,20-21H2,1-6H3,(H,35,40)(H,36,38)(H,37,41)