5-[[1-(6-bromanylpyridin-2-yl)pyrrolidin-3-yl]amino]-2-propan-2-yl-2-thiophen-2-yl-pentanenitrile

Systemtic Name: 5-[[1-(6-bromanylpyridin-2-yl)pyrrolidin-3-yl]amino]-2-propan-2-yl-2-thiophen-2-yl-pentanenitrile Openeye Name: 5-[[1-(6-bromo-2-pyridyl)pyrrolidin-3-yl]amino]-2-isopropyl-2-(2-thienyl)pentanenitrile CAS Name: 5-[[1-(6-bromo-2-pyridinyl)-3-pyrrolidinyl]amino]-2-propan-2-yl-2-thiophen-2-ylpentanenitrile IUPAC Name: 5-[[1-(6-bromopyridin-2-yl)pyrrolidin-3-yl]amino]-2-propan-2-yl-2-thiophen-2-ylpentanenitrile Traditional Name: 5-[[1-(6-bromo-2-pyridyl)pyrrolidin-3-yl]amino]-2-isopropyl-2-(2-thienyl)valeronitrile Formula: C21H27BrN4S MolecularWeight: 447.43488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCNC1CCN(C1)C2=NC(=CC=C2)Br)(C#N)C3=CC=CS3

Isomeric SMILES

CC(C)C(CCCNC1CCN(C1)C2=NC(=CC=C2)Br)(C#N)C3=CC=CS3

InChI

InChI=1S/C21H27BrN4S/c1-16(2)21(15-23,18-6-4-13-27-18)10-5-11-24-17-9-12-26(14-17)20-8-3-7-19(22)25-20/h3-4,6-8,13,16-17,24H,5,9-12,14H2,1-2H3