6-(benzylsulfanyl)-4,5,7,9,13-pentaazapentacyclo[11.8.0.0³,¹¹.0?,?.0¹?,²¹]henicosa-3(11),5,7,9,16(21),17,19-heptaen-12-one

CAS: 344263-06-5

Formula: C23H19N5OS

SMILES: O=C1N2CCC3=C(C=CC=C3)C2CC2=C1C=NC1=NC(SCC3=CC=CC=C3)=NN21

IUPAC: 6-(benzylsulfanyl)-4,5,7,9,13-pentaazapentacyclo[11.8.0.0³,¹¹.0?,?.0¹?,²¹]henicosa-3(11),5,7,9,16(21),17,19-heptaen-12-one

InChI: InChI=1/C23H19N5OS/c29-21-18-13-24-22-25-23(30-14-15-6-2-1-3-7-15)26-28(22)20(18)12-19-17-9-5-4-8-16(17)10-11-27(19)21/h1-9,13,19H,10-12,14H2

Composition: C (66.81%), H (4.63%), N (16.94%), O (3.87%), S (7.75%)

Molar Mass: 413.5

Atom Count: 49

Heavy Atom Count: 30