[(Z,3S,4R,5S)-3-methyl-5-phenylmethoxy-4-phenylsulfanyl-hex-1-enyl] N,N-di(propan-2-yl)carbamate

Systemtic Name: [(Z,3S,4R,5S)-3-methyl-5-phenylmethoxy-4-phenylsulfanyl-hex-1-enyl] N,N-di(propan-2-yl)carbamate Openeye Name: [(Z,3S,4R,5S)-5-benzyloxy-3-methyl-4-phenylsulfanyl-hex-1-enyl] N,N-diisopropylcarbamate CAS Name: N,N-di(propan-2-yl)carbamic acid [(Z,3S,4R,5S)-3-methyl-5-phenylmethoxy-4-(phenylthio)hex-1-enyl] ester IUPAC Name: [(Z,3S,4R,5S)-3-methyl-5-phenylmethoxy-4-phenylsulfanylhex-1-enyl] N,N-di(propan-2-yl)carbamate Traditional Name: N,N-diisopropylcarbamic acid [(Z,3S,4R,5S)-5-benzoxy-3-methyl-4-(phenylthio)hex-1-enyl] ester Formula: C27H37NO3S MolecularWeight: 455.65258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)OC=CC(C)C(C(C)OCC1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

C[C@@H](/C=C\OC(=O)N(C(C)C)C(C)C)[C@H]([C@H](C)OCC1=CC=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C27H37NO3S/c1-20(2)28(21(3)4)27(29)30-18-17-22(5)26(32-25-15-11-8-12-16-25)23(6)31-19-24-13-9-7-10-14-24/h7-18,20-23,26H,19H2,1-6H3/b18-17-/t22-,23-,26+/m0/s1