1-[5-chloranyl-4-(oxolan-3-ylmethoxy)-2-pyrrolidin-1-yl-phenyl]-3-(5-cyanopyrazin-2-yl)urea

Systemtic Name: 1-[5-chloranyl-4-(oxolan-3-ylmethoxy)-2-pyrrolidin-1-yl-phenyl]-3-(5-cyanopyrazin-2-yl)urea Openeye Name: 1-[5-chloro-2-pyrrolidin-1-yl-4-(tetrahydrofuran-3-ylmethoxy)phenyl]-3-(5-cyanopyrazin-2-yl)urea CAS Name: 1-[5-chloro-4-(3-oxolanylmethoxy)-2-(1-pyrrolidinyl)phenyl]-3-(5-cyano-2-pyrazinyl)urea IUPAC Name: 1-[5-chloro-4-(oxolan-3-ylmethoxy)-2-pyrrolidin-1-ylphenyl]-3-(5-cyanopyrazin-2-yl)urea Traditional Name: 1-[5-chloro-2-pyrrolidino-4-(tetrahydrofuran-3-ylmethoxy)phenyl]-3-(5-cyanopyrazin-2-yl)urea Formula: C21H23ClN6O3 MolecularWeight: 442.89872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=C(C=C2NC(=O)NC3=NC=C(N=C3)C#N)Cl)OCC4CCOC4

Isomeric SMILES

C1CCN(C1)C2=CC(=C(C=C2NC(=O)NC3=NC=C(N=C3)C#N)Cl)OCC4CCOC4

InChI

InChI=1S/C21H23ClN6O3/c22-16-7-17(26-21(29)27-20-11-24-15(9-23)10-25-20)18(28-4-1-2-5-28)8-19(16)31-13-14-3-6-30-12-14/h7-8,10-11,14H,1-6,12-13H2,(H2,25,26,27,29)