1-[1-(3-chloranylpyridin-2-yl)pyrrolidin-3-yl]-3-(1-methylisoquinolin-5-yl)urea

Systemtic Name: 1-[1-(3-chloranylpyridin-2-yl)pyrrolidin-3-yl]-3-(1-methylisoquinolin-5-yl)urea Openeye Name: 1-[1-(3-chloro-2-pyridyl)pyrrolidin-3-yl]-3-(1-methyl-5-isoquinolyl)urea CAS Name: 1-[1-(3-chloro-2-pyridinyl)-3-pyrrolidinyl]-3-(1-methyl-5-isoquinolinyl)urea IUPAC Name: 1-[1-(3-chloropyridin-2-yl)pyrrolidin-3-yl]-3-(1-methylisoquinolin-5-yl)urea Traditional Name: 1-[1-(3-chloro-2-pyridyl)pyrrolidin-3-yl]-3-(1-methyl-5-isoquinolyl)urea Formula: C20H20ClN5O MolecularWeight: 381.8587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC2=C1C=CC=C2NC(=O)NC3CCN(C3)C4=C(C=CC=N4)Cl

Isomeric SMILES

CC1=NC=CC2=C1C=CC=C2NC(=O)NC3CCN(C3)C4=C(C=CC=N4)Cl

InChI

InChI=1S/C20H20ClN5O/c1-13-15-4-2-6-18(16(15)7-10-22-13)25-20(27)24-14-8-11-26(12-14)19-17(21)5-3-9-23-19/h2-7,9-10,14H,8,11-12H2,1H3,(H2,24,25,27)