tert-butyl N-[(2S)-1-[[(2S)-5-[[azanyl-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylidene]amino]-1-oxidanyl-1-(1,3-thiazol-2-yl)pentan-2-yl]amino]-3-(3-methylphenyl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[[(2S)-5-[[azanyl-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylidene]amino]-1-oxidanyl-1-(1,3-thiazol-2-yl)pentan-2-yl]amino]-3-(3-methylphenyl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-[[(1S)-4-[[amino-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylene]amino]-1-[hydroxy(thiazol-2-yl)methyl]butyl]amino]-1-(m-tolylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[(2S)-5-[[amino-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]methylidene]amino]-1-hydroxy-1-(2-thiazolyl)pentan-2-yl]amino]-3-(3-methylphenyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[[(2S)-5-[[amino-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]methylidene]amino]-1-hydroxy-1-(1,3-thiazol-2-yl)pentan-2-yl]amino]-3-(3-methylphenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[[(1S)-4-[[amino-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylene]amino]-1-[hydroxy(thiazol-2-yl)methyl]butyl]amino]-2-keto-1-(3-methylbenzyl)ethyl]carbamic acid tert-butyl ester Formula: C34H48N6O7S2 MolecularWeight: 716.91092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(C(=O)NC(CCCN=C(N)NS(=O)(=O)C2=C(C(=C(C=C2C)OC)C)C)C(C3=NC=CS3)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)C[C@@H](C(=O)N[C@@H](CCCN=C(N)NS(=O)(=O)C2=C(C(=C(C=C2C)OC)C)C)C(C3=NC=CS3)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C34H48N6O7S2/c1-20-11-9-12-24(17-20)19-26(39-33(43)47-34(5,6)7)30(42)38-25(28(41)31-36-15-16-48-31)13-10-14-37-32(35)40-49(44,45)29-21(2)18-27(46-8)22(3)23(29)4/h9,11-12,15-18,25-26,28,41H,10,13-14,19H2,1-8H3,(H,38,42)(H,39,43)(H3,35,37,40)/t25-,26-,28?/m0/s1