5-(cyclohexylmethylsulfanyl)-7-methyl-1-phenyl-2-phenylazanyl-1,6-naphthyridin-4-one

Systemtic Name: 5-(cyclohexylmethylsulfanyl)-7-methyl-1-phenyl-2-phenylazanyl-1,6-naphthyridin-4-one Openeye Name: 2-anilino-5-(cyclohexylmethylsulfanyl)-7-methyl-1-phenyl-1,6-naphthyridin-4-one CAS Name: 2-anilino-5-(cyclohexylmethylthio)-7-methyl-1-phenyl-1,6-naphthyridin-4-one IUPAC Name: 2-anilino-5-(cyclohexylmethylsulfanyl)-7-methyl-1-phenyl-1,6-naphthyridin-4-one Traditional Name: 2-anilino-5-(cyclohexylmethylthio)-7-methyl-1-phenyl-1,6-naphthyridin-4-one Formula: C28H29N3OS MolecularWeight: 455.61436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=C1)N(C(=CC2=O)NC3=CC=CC=C3)C4=CC=CC=C4)SCC5CCCCC5

Isomeric SMILES

CC1=NC(=C2C(=C1)N(C(=CC2=O)NC3=CC=CC=C3)C4=CC=CC=C4)SCC5CCCCC5

InChI

InChI=1S/C28H29N3OS/c1-20-17-24-27(28(29-20)33-19-21-11-5-2-6-12-21)25(32)18-26(30-22-13-7-3-8-14-22)31(24)23-15-9-4-10-16-23/h3-4,7-10,13-18,21,30H,2,5-6,11-12,19H2,1H3