ethyl (2E)-2-[(2R)-2-azanyl-3-(triphenylmethyl)sulfanyl-propylidene]octanoate

Systemtic Name: ethyl (2E)-2-[(2R)-2-azanyl-3-(triphenylmethyl)sulfanyl-propylidene]octanoate Openeye Name: ethyl (2E)-2-[(2R)-2-amino-3-tritylsulfanyl-propylidene]octanoate CAS Name: (2E)-2-[(2R)-2-amino-3-[(triphenylmethyl)thio]propylidene]octanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(2R)-2-amino-3-tritylsulfanylpropylidene]octanoate Traditional Name: (E,4R)-4-amino-2-hexyl-5-(tritylthio)pent-2-enoic acid ethyl ester Formula: C32H39NO2S MolecularWeight: 501.72256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=CC(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N)C(=O)OCC

Isomeric SMILES

CCCCCC/C(=C\[C@H](CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N)/C(=O)OCC

InChI

InChI=1S/C32H39NO2S/c1-3-5-6-10-17-26(31(34)35-4-2)24-30(33)25-36-32(27-18-11-7-12-19-27,28-20-13-8-14-21-28)29-22-15-9-16-23-29/h7-9,11-16,18-24,30H,3-6,10,17,25,33H2,1-2H3/b26-24+/t30-/m1/s1