[4-[[(2S)-2-azanylpropanoyl]amino]-2,6-di(propan-2-yl)phenyl] N-[2-[2,4,6-tri(propan-2-yl)phenyl]ethanoyl]sulfamate

Systemtic Name: [4-[[(2S)-2-azanylpropanoyl]amino]-2,6-di(propan-2-yl)phenyl] N-[2-[2,4,6-tri(propan-2-yl)phenyl]ethanoyl]sulfamate Openeye Name: [4-[[(2S)-2-aminopropanoyl]amino]-2,6-diisopropyl-phenyl] N-[2-(2,4,6-triisopropylphenyl)acetyl]sulfamate CAS Name: N-[1-oxo-2-[2,4,6-tri(propan-2-yl)phenyl]ethyl]sulfamic acid [4-[[(2S)-2-amino-1-oxopropyl]amino]-2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [4-[[(2S)-2-aminopropanoyl]amino]-2,6-di(propan-2-yl)phenyl] N-[2-[2,4,6-tri(propan-2-yl)phenyl]acetyl]sulfamate Traditional Name: N-[2-(2,4,6-triisopropylphenyl)acetyl]sulfamic acid [4-[[(2S)-2-aminopropanoyl]amino]-2,6-diisopropyl-phenyl] ester Formula: C32H49N3O5S MolecularWeight: 587.81356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)CC(=O)NS(=O)(=O)OC2=C(C=C(C=C2C(C)C)NC(=O)C(C)N)C(C)C)C(C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C(=C1)C(C)C)OS(=O)(=O)NC(=O)CC2=C(C=C(C=C2C(C)C)C(C)C)C(C)C)C(C)C)N

InChI

InChI=1S/C32H49N3O5S/c1-17(2)23-12-25(18(3)4)29(26(13-23)19(5)6)16-30(36)35-41(38,39)40-31-27(20(7)8)14-24(15-28(31)21(9)10)34-32(37)22(11)33/h12-15,17-22H,16,33H2,1-11H3,(H,34,37)(H,35,36)/t22-/m0/s1