1-[(4-bromophenyl)methyl]-3-(3-chloranylisoquinolin-5-yl)urea

Systemtic Name: 1-[(4-bromophenyl)methyl]-3-(3-chloranylisoquinolin-5-yl)urea Openeye Name: 1-[(4-bromophenyl)methyl]-3-(3-chloro-5-isoquinolyl)urea CAS Name: 1-[(4-bromophenyl)methyl]-3-(3-chloro-5-isoquinolinyl)urea IUPAC Name: 1-[(4-bromophenyl)methyl]-3-(3-chloroisoquinolin-5-yl)urea Traditional Name: 1-(4-bromobenzyl)-3-(3-chloro-5-isoquinolyl)urea Formula: C17H13BrClN3O MolecularWeight: 390.66162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CN=C(C=C2C(=C1)NC(=O)NCC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC2=CN=C(C=C2C(=C1)NC(=O)NCC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C17H13BrClN3O/c18-13-6-4-11(5-7-13)9-21-17(23)22-15-3-1-2-12-10-20-16(19)8-14(12)15/h1-8,10H,9H2,(H2,21,22,23)