9H-fluoren-9-ylmethyl N-[(2R)-3-(tert-butyldisulfanyl)-1-[[4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxycyclohexyl]amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N-[(2R)-3-(tert-butyldisulfanyl)-1-[[4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxycyclohexyl]amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N-[(1R)-1-[(tert-butyldisulfanyl)methyl]-2-[[4-[2-cyanoethoxy-(diisopropylamino)phosphanyl]oxycyclohexyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-3-(tert-butyldisulfanyl)-1-[[4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphino]oxycyclohexyl]amino]-1-oxopropan-2-yl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N-[(2R)-3-(tert-butyldisulfanyl)-1-[[4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxycyclohexyl]amino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1R)-1-[(tert-butyldisulfanyl)methyl]-2-[[4-[2-cyanoethoxy-(diisopropylamino)phosphino]oxycyclohexyl]amino]-2-keto-ethyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C37H53N4O5PS2 MolecularWeight: 728.944281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)P(OCCC#N)OC1CCC(CC1)NC(=O)C(CSSC(C)(C)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)N(C(C)C)P(OCCC#N)OC1CCC(CC1)NC(=O)[C@H](CSSC(C)(C)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C37H53N4O5PS2/c1-25(2)41(26(3)4)47(45-22-12-21-38)46-28-19-17-27(18-20-28)39-35(42)34(24-48-49-37(5,6)7)40-36(43)44-23-33-31-15-10-8-13-29(31)30-14-9-11-16-32(30)33/h8-11,13-16,25-28,33-34H,12,17-20,22-24H2,1-7H3,(H,39,42)(H,40,43)/t27?,28?,34-,47?/m0/s1