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

Systemtic Name: 1-[5-chloranyl-4-(oxolan-2-ylmethoxy)-2-pyrrolidin-1-yl-phenyl]-3-(5-cyanopyrazin-2-yl)urea Openeye Name: 1-[5-chloro-2-pyrrolidin-1-yl-4-(tetrahydrofuran-2-ylmethoxy)phenyl]-3-(5-cyanopyrazin-2-yl)urea CAS Name: 1-[5-chloro-4-(2-oxolanylmethoxy)-2-(1-pyrrolidinyl)phenyl]-3-(5-cyano-2-pyrazinyl)urea IUPAC Name: 1-[5-chloro-4-(oxolan-2-ylmethoxy)-2-pyrrolidin-1-ylphenyl]-3-(5-cyanopyrazin-2-yl)urea Traditional Name: 1-[5-chloro-2-pyrrolidino-4-(tetrahydrofurfuryloxy)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)OCC4CCCO4

Isomeric SMILES

C1CCN(C1)C2=CC(=C(C=C2NC(=O)NC3=NC=C(N=C3)C#N)Cl)OCC4CCCO4

InChI

InChI=1S/C21H23ClN6O3/c22-16-8-17(26-21(29)27-20-12-24-14(10-23)11-25-20)18(28-5-1-2-6-28)9-19(16)31-13-15-4-3-7-30-15/h8-9,11-12,15H,1-7,13H2,(H2,25,26,27,29)