tert-butyl N,N-bis[3-[(2-methylpropan-2-yl)oxycarbonyl-(4-sulfanylphenyl)amino]propyl]carbamate

Systemtic Name: tert-butyl N,N-bis[3-[(2-methylpropan-2-yl)oxycarbonyl-(4-sulfanylphenyl)amino]propyl]carbamate Openeye Name: tert-butyl N,N-bis[3-(N-tert-butoxycarbonyl-4-sulfanyl-anilino)propyl]carbamate CAS Name: N,N-bis[3-(4-mercapto-N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N,N-bis[3-[N-[(2-methylpropan-2-yl)oxycarbonyl]-4-sulfanylanilino]propyl]carbamate Traditional Name: N,N-bis[3-(N-tert-butoxycarbonyl-4-mercapto-anilino)propyl]carbamic acid tert-butyl ester Formula: C33H49N3O6S2 MolecularWeight: 647.88866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCN(C1=CC=C(C=C1)S)C(=O)OC(C)(C)C)CCCN(C2=CC=C(C=C2)S)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCN(C1=CC=C(C=C1)S)C(=O)OC(C)(C)C)CCCN(C2=CC=C(C=C2)S)C(=O)OC(C)(C)C

InChI

InChI=1S/C33H49N3O6S2/c1-31(2,3)40-28(37)34(20-10-22-35(29(38)41-32(4,5)6)24-12-16-26(43)17-13-24)21-11-23-36(30(39)42-33(7,8)9)25-14-18-27(44)19-15-25/h12-19,43-44H,10-11,20-23H2,1-9H3