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

Systemtic Name: 1-(3-methylisoquinolin-5-yl)-3-[1-(phenylmethyl)pyrrolidin-3-yl]urea Openeye Name: 1-(1-benzylpyrrolidin-3-yl)-3-(3-methyl-5-isoquinolyl)urea CAS Name: 1-(3-methyl-5-isoquinolinyl)-3-[1-(phenylmethyl)-3-pyrrolidinyl]urea IUPAC Name: 1-(1-benzylpyrrolidin-3-yl)-3-(3-methylisoquinolin-5-yl)urea Traditional Name: 1-(1-benzylpyrrolidin-3-yl)-3-(3-methyl-5-isoquinolyl)urea Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O/c1-16-12-20-18(13-23-16)8-5-9-21(20)25-22(27)24-19-10-11-26(15-19)14-17-6-3-2-4-7-17/h2-9,12-13,19H,10-11,14-15H2,1H3,(H2,24,25,27)