[3-(2-hydroxyethyl)-4-[(3-sulfanylpyrrolidin-2-yl)methyl]piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [3-(2-hydroxyethyl)-4-[(3-sulfanylpyrrolidin-2-yl)methyl]piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [3-(2-hydroxyethyl)-4-[(3-sulfanylpyrrolidin-2-yl)methyl]piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [3-(2-hydroxyethyl)-4-[(3-mercapto-2-pyrrolidinyl)methyl]-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [3-(2-hydroxyethyl)-4-[(3-sulfanylpyrrolidin-2-yl)methyl]piperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [3-(2-hydroxyethyl)-4-[(3-mercaptopyrrolidin-2-yl)methyl]piperazino]-(1-naphthyl)methanone Formula: C22H29N3O2S MolecularWeight: 399.54956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C1S)CN2CCN(CC2CCO)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CNC(C1S)CN2CCN(CC2CCO)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H29N3O2S/c26-13-9-17-14-25(12-11-24(17)15-20-21(28)8-10-23-20)22(27)19-7-3-5-16-4-1-2-6-18(16)19/h1-7,17,20-21,23,26,28H,8-15H2