6,7-dimethoxy-2-[(4-methylphenyl)methylsulfanyl]-3-octyl-quinazolin-4-imine

Systemtic Name: 6,7-dimethoxy-2-[(4-methylphenyl)methylsulfanyl]-3-octyl-quinazolin-4-imine Openeye Name: 6,7-dimethoxy-3-octyl-2-(p-tolylmethylsulfanyl)quinazolin-4-imine CAS Name: 6,7-dimethoxy-2-[(4-methylphenyl)methylthio]-3-octyl-4-quinazolinimine IUPAC Name: 6,7-dimethoxy-2-[(4-methylphenyl)methylsulfanyl]-3-octylquinazolin-4-imine Traditional Name: [6,7-dimethoxy-2-[(4-methylbenzyl)thio]-3-octyl-quinazolin-4-ylidene]amine Formula: C26H35N3O2S MolecularWeight: 453.64

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=N)C2=CC(=C(C=C2N=C1SCC3=CC=C(C=C3)C)OC)OC

Isomeric SMILES

CCCCCCCCN1C(=N)C2=CC(=C(C=C2N=C1SCC3=CC=C(C=C3)C)OC)OC

InChI

InChI=1S/C26H35N3O2S/c1-5-6-7-8-9-10-15-29-25(27)21-16-23(30-3)24(31-4)17-22(21)28-26(29)32-18-20-13-11-19(2)12-14-20/h11-14,16-17,27H,5-10,15,18H2,1-4H3