1-[4-(3-oxidanylidene-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[4-(3-oxidanylidene-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-(3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]urea CAS Name: 1-[4-(3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-(3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]urea Traditional Name: 1-benzyl-3-[4-(3-keto-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]urea Formula: C23H21N3O2 MolecularWeight: 371.43174

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2/c27-21-14-18-8-4-5-9-20(18)22(26-21)17-10-12-19(13-11-17)25-23(28)24-15-16-6-2-1-3-7-16/h1-13,22H,14-15H2,(H,26,27)(H2,24,25,28)