[2-[[(1R)-1-naphthalen-2-ylethyl]amino]-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate

Systemtic Name: [2-[[(1R)-1-naphthalen-2-ylethyl]amino]-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate Openeye Name: [2-[[(1R)-1-(2-naphthyl)ethyl]amino]-2-oxo-ethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate CAS Name: 2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]acetic acid [2-[[(1R)-1-(2-naphthalenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R)-1-naphthalen-2-ylethyl]amino]-2-oxoethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate Traditional Name: 2-(pyrrolidine-1-carbothioylthio)acetic acid [2-keto-2-[[(1R)-1-(2-naphthyl)ethyl]amino]ethyl] ester Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)NC(=O)COC(=O)CSC(=S)N3CCCC3

Isomeric SMILES

C[C@H](C1=CC2=CC=CC=C2C=C1)NC(=O)COC(=O)CSC(=S)N3CCCC3

InChI

InChI=1S/C21H24N2O3S2/c1-15(17-9-8-16-6-2-3-7-18(16)12-17)22-19(24)13-26-20(25)14-28-21(27)23-10-4-5-11-23/h2-3,6-9,12,15H,4-5,10-11,13-14H2,1H3,(H,22,24)/t15-/m1/s1