1-(6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanone

Systemtic Name: 1-(6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanone Openeye Name: 1-(6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanone CAS Name: 1-(6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-(5H-pyrimido[5,4-b]indol-4-ylthio)ethanone IUPAC Name: 1-(6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanone Traditional Name: 1-(6-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-(5H-pyrimid[5,4-b]indol-4-ylthio)ethanone Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCCN2C(=O)CSC3=NC=NC4=C3NC5=CC=CC=C54

Isomeric SMILES

CC1=CC2=C(C=C1)OCCN2C(=O)CSC3=NC=NC4=C3NC5=CC=CC=C54

InChI

InChI=1S/C21H18N4O2S/c1-13-6-7-17-16(10-13)25(8-9-27-17)18(26)11-28-21-20-19(22-12-23-21)14-4-2-3-5-15(14)24-20/h2-7,10,12,24H,8-9,11H2,1H3