[2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: [2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: [2-[[(1R)-1-methylpropyl]amino]-2-oxo-ethyl] 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid [2-[[(2R)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]amino]-2-oxoethyl] 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid [2-keto-2-[[(1R)-1-methylpropyl]amino]ethyl] ester Formula: C18H20ClNO3S MolecularWeight: 365.8743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)CSC1=CC=CC2=C1C(=CC=C2)Cl

Isomeric SMILES

CC[C@@H](C)NC(=O)COC(=O)CSC1=CC=CC2=C1C(=CC=C2)Cl

InChI

InChI=1S/C18H20ClNO3S/c1-3-12(2)20-16(21)10-23-17(22)11-24-15-9-5-7-13-6-4-8-14(19)18(13)15/h4-9,12H,3,10-11H2,1-2H3,(H,20,21)/t12-/m1/s1