3-methylbut-2-enyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-5-(triphenylmethyl)sulfanyl-pent-2-enoate

Systemtic Name: 3-methylbut-2-enyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-5-(triphenylmethyl)sulfanyl-pent-2-enoate Openeye Name: 3-methylbut-2-enyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-5-tritylsulfanyl-pent-2-enoate CAS Name: (E,4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-methyl-5-[(triphenylmethyl)thio]-2-pentenoic acid 3-methylbut-2-enyl ester IUPAC Name: 3-methylbut-2-enyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-5-tritylsulfanylpent-2-enoate Traditional Name: (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-5-(tritylthio)pent-2-enoic acid 3-methylbut-2-enyl ester Formula: C45H43NO4S MolecularWeight: 693.89222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C(=CC(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46)C)C

Isomeric SMILES

CC(=CCOC(=O)/C(=C/[C@@H](CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46)/C)C

InChI

InChI=1S/C45H43NO4S/c1-32(2)27-28-49-43(47)33(3)29-37(46-44(48)50-30-42-40-25-15-13-23-38(40)39-24-14-16-26-41(39)42)31-51-45(34-17-7-4-8-18-34,35-19-9-5-10-20-35)36-21-11-6-12-22-36/h4-27,29,37,42H,28,30-31H2,1-3H3,(H,46,48)/b33-29+/t37-/m0/s1