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

Systemtic Name: 1-tert-butyl-3-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-tert-butyl-3-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-tert-butyl-3-[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-tert-butyl-3-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-tert-butyl-3-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=CC2=C(CCN(C2)C(=O)C3CC3)C=C1

Isomeric SMILES

CC(C)(C)NC(=O)NC1=CC2=C(CCN(C2)C(=O)C3CC3)C=C1

InChI

InChI=1S/C18H25N3O2/c1-18(2,3)20-17(23)19-15-7-6-12-8-9-21(11-14(12)10-15)16(22)13-4-5-13/h6-7,10,13H,4-5,8-9,11H2,1-3H3,(H2,19,20,23)