2-azanylidene-1-[(4-chlorophenyl)methyl]-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]quinazolin-4-one

Systemtic Name: 2-azanylidene-1-[(4-chlorophenyl)methyl]-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]quinazolin-4-one Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-2-imino-quinazolin-4-one CAS Name: 1-[(4-chlorophenyl)methyl]-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-imino-4-quinazolinone IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-iminoquinazolin-4-one Traditional Name: 1-(4-chlorobenzyl)-3-(3,5-ditert-butyl-4-hydroxy-benzyl)-2-imino-quinazolin-4-one Formula: C30H34ClN3O2 MolecularWeight: 504.06286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2C(=O)C3=CC=CC=C3N(C2=N)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2C(=O)C3=CC=CC=C3N(C2=N)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C30H34ClN3O2/c1-29(2,3)23-15-20(16-24(26(23)35)30(4,5)6)18-34-27(36)22-9-7-8-10-25(22)33(28(34)32)17-19-11-13-21(31)14-12-19/h7-16,32,35H,17-18H2,1-6H3