2-(diphenylmethyl)sulfanyl-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-(diphenylmethyl)sulfanyl-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-benzhydrylsulfanyl-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-[(diphenylmethyl)thio]-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-benzhydrylsulfanyl-3-(2-methoxyethyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-(benzhydrylthio)-3-(2-methoxyethyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C26H23N3O2S MolecularWeight: 441.54472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COCCN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O2S/c1-31-17-16-29-25(30)23-22(20-14-8-9-15-21(20)27-23)28-26(29)32-24(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-15,24,27H,16-17H2,1H3