N-[[1-[(6-phenoxypyridin-3-yl)methyl]pyrrolidin-3-yl]methylsulfanyl]carbamate

Systemtic Name: N-[[1-[(6-phenoxypyridin-3-yl)methyl]pyrrolidin-3-yl]methylsulfanyl]carbamate Openeye Name: N-[[1-[(6-phenoxy-3-pyridyl)methyl]pyrrolidin-3-yl]methylsulfanyl]carbamate CAS Name: N-[[1-[(6-phenoxy-3-pyridinyl)methyl]-3-pyrrolidinyl]methylthio]carbamate IUPAC Name: N-[[1-[(6-phenoxypyridin-3-yl)methyl]pyrrolidin-3-yl]methylsulfanyl]carbamate Traditional Name: N-[[1-[(6-phenoxy-3-pyridyl)methyl]pyrrolidin-3-yl]methylthio]carbamate Formula: C18H20N3O3S- MolecularWeight: 358.4347

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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)/p-1