[4-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]phenyl]-pyrrolidino-methanone Formula: C20H20N2O2S MolecularWeight: 352.45

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C20H20N2O2S/c1-14-5-4-6-17-18(14)21-20(24-17)25-13-15-7-9-16(10-8-15)19(23)22-11-2-3-12-22/h4-10H,2-3,11-13H2,1H3