9H-fluoren-9-ylmethyl N-[2-[(6-tert-butyl-5-cyano-3-diethoxyphosphoryl-4-sulfanylidene-pyran-2-yl)amino]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N-[2-[(6-tert-butyl-5-cyano-3-diethoxyphosphoryl-4-sulfanylidene-pyran-2-yl)amino]-2-oxidanylidene-ethyl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N-[2-[(6-tert-butyl-5-cyano-3-diethoxyphosphoryl-4-thioxo-pyran-2-yl)amino]-2-oxo-ethyl]carbamate CAS Name: N-[2-[(6-tert-butyl-5-cyano-3-diethoxyphosphoryl-4-sulfanylidene-2-pyranyl)amino]-2-oxoethyl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N-[2-[(6-tert-butyl-5-cyano-3-diethoxyphosphoryl-4-sulfanylidenepyran-2-yl)amino]-2-oxoethyl]carbamate Traditional Name: N-[2-[(6-tert-butyl-5-cyano-3-diethoxyphosphoryl-4-thioxo-pyran-2-yl)amino]-2-keto-ethyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C31H34N3O7PS MolecularWeight: 623.656321

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(OC(=C(C1=S)C#N)C(C)(C)C)NC(=O)CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)OCC

Isomeric SMILES

CCOP(=O)(C1=C(OC(=C(C1=S)C#N)C(C)(C)C)NC(=O)CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)OCC

InChI

InChI=1S/C31H34N3O7PS/c1-6-39-42(37,40-7-2)26-27(43)23(16-32)28(31(3,4)5)41-29(26)34-25(35)17-33-30(36)38-18-24-21-14-10-8-12-19(21)20-13-9-11-15-22(20)24/h8-15,24H,6-7,17-18H2,1-5H3,(H,33,36)(H,34,35)