1-(4-butoxyphenyl)-3-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-(4-butoxyphenyl)-3-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-(4-butoxyphenyl)-3-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-(4-butoxyphenyl)-3-[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(4-butoxyphenyl)-3-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(4-butoxyphenyl)-3-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Formula: C24H29N3O3 MolecularWeight: 407.50536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)NC2=CC3=C(CCN(C3)C(=O)C4CC4)C=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)NC2=CC3=C(CCN(C3)C(=O)C4CC4)C=C2

InChI

InChI=1S/C24H29N3O3/c1-2-3-14-30-22-10-8-20(9-11-22)25-24(29)26-21-7-6-17-12-13-27(16-19(17)15-21)23(28)18-4-5-18/h6-11,15,18H,2-5,12-14,16H2,1H3,(H2,25,26,29)