N-[1-(phenylmethyl)pyrrolidin-3-yl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[1-(phenylmethyl)pyrrolidin-3-yl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[1-(phenylmethyl)-3-pyrrolidinyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-(2-pyrimidylthio)acetamide Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)CSC2=NC=CC=N2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1NC(=O)CSC2=NC=CC=N2)CC3=CC=CC=C3

InChI

InChI=1S/C17H20N4OS/c22-16(13-23-17-18-8-4-9-19-17)20-15-7-10-21(12-15)11-14-5-2-1-3-6-14/h1-6,8-9,15H,7,10-13H2,(H,20,22)