1-[1-(3-chloranyl-6-methoxy-pyridin-2-yl)piperidin-4-yl]-3-(1,3-dimethylisoquinolin-5-yl)urea

Systemtic Name: 1-[1-(3-chloranyl-6-methoxy-pyridin-2-yl)piperidin-4-yl]-3-(1,3-dimethylisoquinolin-5-yl)urea Openeye Name: 1-[1-(3-chloro-6-methoxy-2-pyridyl)-4-piperidyl]-3-(1,3-dimethyl-5-isoquinolyl)urea CAS Name: 1-[1-(3-chloro-6-methoxy-2-pyridinyl)-4-piperidinyl]-3-(1,3-dimethyl-5-isoquinolinyl)urea IUPAC Name: 1-[1-(3-chloro-6-methoxypyridin-2-yl)piperidin-4-yl]-3-(1,3-dimethylisoquinolin-5-yl)urea Traditional Name: 1-[1-(3-chloro-6-methoxy-2-pyridyl)-4-piperidyl]-3-(1,3-dimethyl-5-isoquinolyl)urea Formula: C23H26ClN5O2 MolecularWeight: 439.93784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C=CC=C(C2=C1)NC(=O)NC3CCN(CC3)C4=C(C=CC(=N4)OC)Cl)C

Isomeric SMILES

CC1=NC(=C2C=CC=C(C2=C1)NC(=O)NC3CCN(CC3)C4=C(C=CC(=N4)OC)Cl)C

InChI

InChI=1S/C23H26ClN5O2/c1-14-13-18-17(15(2)25-14)5-4-6-20(18)27-23(30)26-16-9-11-29(12-10-16)22-19(24)7-8-21(28-22)31-3/h4-8,13,16H,9-12H2,1-3H3,(H2,26,27,30)