S-(2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl) 3-(2,3-dihydro-1H-inden-2-yl)butanethioate

Systemtic Name: S-(2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl) 3-(2,3-dihydro-1H-inden-2-yl)butanethioate Openeye Name: S-[2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 3-indan-2-ylbutanethioate CAS Name: 3-(2,3-dihydro-1H-inden-2-yl)butanethioic acid S-[2-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester IUPAC Name: S-[2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 3-(2,3-dihydro-1H-inden-2-yl)butanethioate Traditional Name: 3-indan-2-ylbutanethioic acid S-[2-(pyrrolidine-1-carbonyl)pyrrolidino] ester Formula: C22H30N2O2S MolecularWeight: 386.5508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)SN1CCCC1C(=O)N2CCCC2)C3CC4=CC=CC=C4C3

Isomeric SMILES

CC(CC(=O)SN1CCCC1C(=O)N2CCCC2)C3CC4=CC=CC=C4C3

InChI

InChI=1S/C22H30N2O2S/c1-16(19-14-17-7-2-3-8-18(17)15-19)13-21(25)27-24-12-6-9-20(24)22(26)23-10-4-5-11-23/h2-3,7-8,16,19-20H,4-6,9-15H2,1H3