[3-[bis(phenylmethyl)amino]-5-methyl-1-methylsulfanyl-2-oxidanylidene-hexyl] ethanoate

Systemtic Name: [3-[bis(phenylmethyl)amino]-5-methyl-1-methylsulfanyl-2-oxidanylidene-hexyl] ethanoate Openeye Name: [3-(dibenzylamino)-5-methyl-1-methylsulfanyl-2-oxo-hexyl] acetate CAS Name: acetic acid [3-[bis(phenylmethyl)amino]-5-methyl-1-(methylthio)-2-oxohexyl] ester IUPAC Name: [3-(dibenzylamino)-5-methyl-1-methylsulfanyl-2-oxohexyl] acetate Traditional Name: acetic acid [3-(dibenzylamino)-2-keto-5-methyl-1-(methylthio)hexyl] ester Formula: C24H31NO3S MolecularWeight: 413.57284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(OC(=O)C)SC)N(CC1=CC=CC=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)C(OC(=O)C)SC)N(CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C24H31NO3S/c1-18(2)15-22(23(27)24(29-4)28-19(3)26)25(16-20-11-7-5-8-12-20)17-21-13-9-6-10-14-21/h5-14,18,22,24H,15-17H2,1-4H3