[1-[(6-phenoxypyridin-3-yl)methyl]pyrrolidin-3-yl]methylsulfanylcarbamic acid

Systemtic Name: [1-[(6-phenoxypyridin-3-yl)methyl]pyrrolidin-3-yl]methylsulfanylcarbamic acid Openeye Name: [1-[(6-phenoxy-3-pyridyl)methyl]pyrrolidin-3-yl]methylsulfanylcarbamic acid CAS Name: [[1-[(6-phenoxy-3-pyridinyl)methyl]-3-pyrrolidinyl]methylthio]carbamic acid IUPAC Name: [1-[(6-phenoxypyridin-3-yl)methyl]pyrrolidin-3-yl]methylsulfanylcarbamic acid Traditional Name: [[1-[(6-phenoxy-3-pyridyl)methyl]pyrrolidin-3-yl]methylthio]carbamic acid Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1CSNC(=O)O)CC2=CN=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1CSNC(=O)O)CC2=CN=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O3S/c22-18(23)20-25-13-15-8-9-21(12-15)11-14-6-7-17(19-10-14)24-16-4-2-1-3-5-16/h1-7,10,15,20H,8-9,11-13H2,(H,22,23)