1-(furan-2-ylmethyl)-3-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)-1-(oxolan-2-ylmethyl)urea

Systemtic Name: 1-(furan-2-ylmethyl)-3-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)-1-(oxolan-2-ylmethyl)urea Openeye Name: 1-(2-furylmethyl)-3-(2-methyl-1-oxo-4-isoquinolyl)-1-(tetrahydrofuran-2-ylmethyl)urea CAS Name: 1-(2-furanylmethyl)-3-(2-methyl-1-oxo-4-isoquinolinyl)-1-(2-oxolanylmethyl)urea IUPAC Name: 1-(furan-2-ylmethyl)-3-(2-methyl-1-oxoisoquinolin-4-yl)-1-(oxolan-2-ylmethyl)urea Traditional Name: 1-(2-furfuryl)-3-(1-keto-2-methyl-4-isoquinolyl)-1-(tetrahydrofurfuryl)urea Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C2C1=O)NC(=O)N(CC3CCCO3)CC4=CC=CO4

Isomeric SMILES

CN1C=C(C2=CC=CC=C2C1=O)NC(=O)N(CC3CCCO3)CC4=CC=CO4

InChI

InChI=1S/C21H23N3O4/c1-23-14-19(17-8-2-3-9-18(17)20(23)25)22-21(26)24(12-15-6-4-10-27-15)13-16-7-5-11-28-16/h2-4,6,8-10,14,16H,5,7,11-13H2,1H3,(H,22,26)