propan-2-yl 4-(quinolin-2-ylsulfanylmethyl)benzoate

Systemtic Name: propan-2-yl 4-(quinolin-2-ylsulfanylmethyl)benzoate Openeye Name: isopropyl 4-(2-quinolylsulfanylmethyl)benzoate CAS Name: 4-[(2-quinolinylthio)methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(quinolin-2-ylsulfanylmethyl)benzoate Traditional Name: 4-[(2-quinolylthio)methyl]benzoic acid isopropyl ester Formula: C20H19NO2S MolecularWeight: 337.43536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H19NO2S/c1-14(2)23-20(22)17-9-7-15(8-10-17)13-24-19-12-11-16-5-3-4-6-18(16)21-19/h3-12,14H,13H2,1-2H3