S-(2-pyrrolidin-1-ylpropyl) 4-methyl-2-phenyl-pentanethioate

Systemtic Name: S-(2-pyrrolidin-1-ylpropyl) 4-methyl-2-phenyl-pentanethioate Openeye Name: S-(2-pyrrolidin-1-ylpropyl) 4-methyl-2-phenyl-pentanethioate CAS Name: 4-methyl-2-phenylpentanethioic acid S-[2-(1-pyrrolidinyl)propyl] ester IUPAC Name: S-(2-pyrrolidin-1-ylpropyl) 4-methyl-2-phenylpentanethioate Traditional Name: 4-methyl-2-phenyl-pentanethioic acid S-(2-pyrrolidinopropyl) ester Formula: C19H29NOS MolecularWeight: 319.50466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)C(=O)SCC(C)N2CCCC2

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)C(=O)SCC(C)N2CCCC2

InChI

InChI=1S/C19H29NOS/c1-15(2)13-18(17-9-5-4-6-10-17)19(21)22-14-16(3)20-11-7-8-12-20/h4-6,9-10,15-16,18H,7-8,11-14H2,1-3H3